#include <CL/cl_platform.h>

Macros
#define	x1_ca -1.5294880

#define	x1_cb 0.0000000

#define	x1_cb_p -0.0119584

#define	x1_cd1 -0.2442786

#define	x1_cd1_w -0.0962845

#define	x1_cd2 1.9679581

#define	x1_cd2_h 1.8770485

#define	x1_cd2_l 1.4893895

#define	x1_cd2_w 1.9952924

#define	x1_cd -0.4783638

#define	x1_cd_p -1.0268733

#define	x1_ce1 0.2943790

#define	x1_ce1_h 0.5944039

#define	x1_ce2 2.5065409

#define	x1_ce2_w 2.0616894

#define	x1_ce3_w 3.1824268

#define	x1_ce_k -1.8711717

#define	x1_ce_m -2.1632737

#define	x1_cg2 0.5326465

#define	x1_cg 0.5915642

#define	x1_cg_p 0.1567080

#define	x1_ch2_w 4.4375384

#define	x1_cz2_w 3.2711149

#define	x1_cz3_w 4.3952531

#define	x1_cz 1.6750406

#define	x1_cz_r -2.0808292

#define	x1_c -2.0462234

#define	x1_nd1_h -0.1880577

#define	x1_nd2_n 1.8976920

#define	x1_ne1_w 0.7775292

#define	x1_ne2_h 1.8507970

#define	x1_ne2_q -0.0574527

#define	x1_ne_r -1.8147512

#define	x1_nh1_r -1.0945695

#define	x1_nh2_r -3.3333551

#define	x1_nv_p -2.0181350

#define	x1_nz_k -1.8249921

#define	x1_n -2.0400342

#define	x1_od1 -0.1517762

#define	x1_od2_d 1.7939259

#define	x1_oe1 -1.6545054

#define	x1_oe2_e -0.1345519

#define	x1_og 0.5021427

#define	x1_oh_y 2.2115206

#define	x1_o -2.3056024

#define	x1_sd_m -0.6700778

#define	x1_sg_c 0.7385894

#define	y1_ca 0.0000000

#define	y1_cb -0.0000000

#define	y1_cb_p 0.1993893

#define	y1_cd1 2.5042751

#define	y1_cd1_w 2.5735523

#define	y1_cd2 1.5674440

#define	y1_cd2_h 1.8213088

#define	y1_cd2_l 1.5685415

#define	y1_cd2_w 1.7533594

#define	y1_cd 2.4630111

#define	y1_cd_p 2.3111539

#define	y1_ce1 3.7764912

#define	y1_ce1_h 3.6003141

#define	y1_ce2 2.8394833

#define	y1_ce2_w 3.1491190

#define	y1_ce3_w 1.0105477

#define	y1_ce_k 1.8503952

#define	y1_ce_m 1.6985493

#define	y1_cg2 -0.7466988

#define	y1_cg 1.3971722

#define	y1_cg_p 1.4764299

#define	y1_ch2_w 3.0607742

#define	y1_cz2_w 3.8259826

#define	y1_cz3_w 1.6893180

#define	y1_cz 3.9408344

#define	y1_cz_r 0.5692133

#define	y1_c -0.7812559

#define	y1_nd1_h 2.5348379

#define	y1_nd2_n 1.4782518

#define	y1_ne1_w 3.6325178

#define	y1_ne2_h 3.1942679

#define	y1_ne2_q 3.7226568

#define	y1_ne_r 1.8899669

#define	y1_nh1_r -0.2999949

#define	y1_nh2_r 0.1474556

#define	y1_nv_p 1.2939697

#define	y1_nz_k 0.3630040

#define	y1_n 1.3656901

#define	y1_od1 2.3674910

#define	y1_od2_d 1.5112570

#define	y1_oe1 2.1388335

#define	y1_oe2_e 3.6216168

#define	y1_og 1.3081245

#define	y1_oh_y 5.2079019

#define	y1_o -0.2101090

#define	y1_sd_m 2.6864031

#define	y1_sg_c 1.6511372

#define	z1_ca 0.0000000

#define	z1_cb 0.0000000

#define	z1_cb_p 0.0661247

#define	z1_cd1 0.0000000

#define	z1_cd1_w 0.0000028

#define	z1_cd2 0.0000000

#define	z1_cd2_h -0.0009351

#define	z1_cd2_l 1.2162614

#define	z1_cd2_w 0.0008309

#define	z1_cd 0.0000007

#define	z1_cd_p 0.4052198

#define	z1_ce1 0.0000000

#define	z1_ce1_h 0.0000084

#define	z1_ce2 0.0000000

#define	z1_ce2_w 0.0013971

#define	z1_ce3_w 0.0019356

#define	z1_ce_k 0.0000013

#define	z1_ce_m 0.0000004

#define	z1_cg2 -1.2132623

#define	z1_cg 0.0000000

#define	z1_cg_p 0.8161961

#define	z1_ch2_w 0.0029114

#define	z1_cz2_w 0.0008706

#define	z1_cz3_w 0.0027443

#define	z1_cz 0.0000000

#define	z1_cz_r 0.0000010

#define	z1_c 1.2012238

#define	z1_nd1_h 0.0000002

#define	z1_nd2_n 0.0000000

#define	z1_ne1_w -0.0006771

#define	z1_ne2_h -0.0009374

#define	z1_ne2_q 0.0000007

#define	z1_ne_r 0.0000011

#define	z1_nh1_r 0.0000004

#define	z1_nh2_r 0.0000015

#define	z1_nv_p 0.0057931

#define	z1_nz_k 0.0000008

#define	z1_n 0.0000000

#define	z1_od1 0.0000000

#define	z1_od2_d 0.0000000

#define	z1_oe1 0.0000011

#define	z1_oe2_e 0.0000007

#define	z1_og 0.0000000

#define	z1_oh_y 0.0000000

#define	z1_o 2.2604272

#define	z1_sd_m 0.0000009

#define	z1_sg_c 0.0000000

#define	x2_ca -0.5963369

#define	x2_cb -0.0000000

#define	x2_cb_p 0.1789471

#define	x2_cd1 2.2108445

#define	x2_cd1_w 2.3323410

#define	x2_cd2 2.2106900

#define	x2_cd2_h 2.4090189

#define	x2_cd2_l 2.0251100

#define	x2_cd2_w 2.3925496

#define	x2_cd 2.0815779

#define	x2_cd_p 1.7278786

#define	x2_ce1 3.5923965

#define	x2_ce1_h 3.5471396

#define	x2_ce2 3.5920500

#define	x2_ce2_w 3.7037366

#define	x2_ce3_w 2.1713794

#define	x2_ce_k 0.9743982

#define	x2_ce_m 0.7206807

#define	x2_cg2 -0.4799299

#define	x2_cg 1.5172470

#define	x2_cg_p 1.4206848

#define	x2_ch2_w 4.5487107

#define	x2_cz2_w 4.7985800

#define	x2_cz3_w 3.2693045

#define	x2_cz 4.2820440

#define	x2_cz_r -0.2871352

#define	x2_c -1.5172358

#define	x2_nd1_h 2.2609087

#define	x2_nd2_n 2.1011602

#define	x2_ne1_w 3.6481941

#define	x2_ne2_h 3.6630869

#define	x2_ne2_q 3.4056457

#define	x2_ne_r 1.0328361

#define	x2_nh1_r -0.7030185

#define	x2_nh2_r -1.1638662

#define	x2_nv_p 0.4047081

#define	x2_nz_k -0.3772760

#define	x2_n 0.4622142

#define	x2_od1 2.1209516

#define	x2_od2_d 2.0910957

#define	x2_oe1 1.3244862

#define	x2_oe2_e 3.2825415

#define	x2_og 1.4003816

#define	x2_oh_y 5.6580058

#define	x2_o -1.0924196

#define	x2_sd_m 2.2125427

#define	x2_sg_c 1.8084373

#define	y2_ca 1.4084445

#define	y2_cb 0.0000000

#define	y2_cb_p 0.0887525

#define	y2_cd1 1.2013461

#define	y2_cd1_w 1.0920749

#define	y2_cd2 -1.2010785

#define	y2_cd2_h -1.0183833

#define	y2_cd2_l -0.7599558

#define	y2_cd2_w -1.1537624

#define	y2_cd 1.4008173

#define	y2_cd_p 1.8467097

#define	y2_ce1 1.2013461

#define	y2_ce1_h 0.8563749

#define	y2_ce2 -1.2010785

#define	y2_ce2_w -0.6707077

#define	y2_ce3_w -2.5365643

#define	y2_ce_k 2.4445438

#define	y2_ce_m 2.6543252

#define	y2_cg2 -0.7816257

#define	y2_cg 0.0000000

#define	y2_cg_p 0.4313438

#define	y2_ch2_w -2.8929773

#define	y2_cz2_w -1.5205149

#define	y2_cz3_w -3.3887598

#define	y2_cz -0.0059738

#define	y2_cz_r 2.1380849

#define	y2_c 1.5796792

#define	y2_nd1_h 1.1614907

#define	y2_nd2_n -1.1711487

#define	y2_ne1_w 0.7002982

#define	y2_ne2_h -0.4589020

#define	y2_ne2_q 1.5043442

#define	y2_ne_r 2.4080171

#define	y2_nh1_r 0.8909794

#define	y2_nh2_r 3.1270457

#define	y2_nv_p 2.3629299

#define	y2_nz_k 1.8220952

#define	y2_n 2.4110593

#define	y2_od1 1.0628332

#define	y2_od2_d -1.0627261

#define	y2_oe1 2.3574845

#define	y2_oe2_e 1.5359470

#define	y2_og 0.0476256

#define	y2_oh_y -0.0059759

#define	y2_o 2.0412172

#define	y2_sd_m 1.6644581

#define	y2_sg_c -0.0363704

#define	z2_ca 0.0000000

#define	z2_cb 0.0000000

#define	z2_cb_p 0.0661247

#define	z2_cd1 0.0000000

#define	z2_cd1_w 0.0000028

#define	z2_cd2 0.0000000

#define	z2_cd2_h -0.0009351

#define	z2_cd2_l 1.2162614

#define	z2_cd2_w 0.0008309

#define	z2_cd 0.0000007

#define	z2_cd_p 0.4052198

#define	z2_ce1 0.0000000

#define	z2_ce1_h 0.0000084

#define	z2_ce2 0.0000000

#define	z2_ce2_w 0.0013971

#define	z2_ce3_w 0.0019356

#define	z2_ce_k 0.0000013

#define	z2_ce_m 0.0000004

#define	z2_cg2 -1.2132623

#define	z2_cg 0.0000000

#define	z2_cg_p 0.8161961

#define	z2_ch2_w 0.0029114

#define	z2_cz2_w 0.0008706

#define	z2_cz3_w 0.0027443

#define	z2_cz 0.0000000

#define	z2_cz_r 0.0000010

#define	z2_c 1.2012238

#define	z2_nd1_h 0.0000002

#define	z2_nd2_n 0.0000000

#define	z2_ne1_w -0.0006771

#define	z2_ne2_h -0.0009374

#define	z2_ne2_q 0.0000007

#define	z2_ne_r 0.0000011

#define	z2_nh1_r 0.0000004

#define	z2_nh2_r 0.0000015

#define	z2_nv_p 0.0057931

#define	z2_nz_k 0.0000008

#define	z2_n 0.0000000

#define	z2_od1 0.0000000

#define	z2_od2_d 0.0000000

#define	z2_oe1 0.0000011

#define	z2_oe2_e 0.0000007

#define	z2_og 0.0000000

#define	z2_oh_y 0.0000000

#define	z2_o 2.2604272

#define	z2_sd_m 0.0000009

#define	z2_sg_c 0.0000000

#define	r_ca 2.0000000

#define	r_cb 2.0000000

#define	r_cb_p 2.0000000

#define	r_cd1 2.0000000

#define	r_cd1_w 2.0000000

#define	r_cd2 2.0000000

#define	r_cd2_h 2.0000000

#define	r_cd2_l 2.0000000

#define	r_cd2_w 2.0000000

#define	r_cd 2.0000000

#define	r_cd_p 2.0000000

#define	r_ce1 2.0000000

#define	r_ce1_h 2.0000000

#define	r_ce2 2.0000000

#define	r_ce2_w 2.0000000

#define	r_ce3_w 2.0000000

#define	r_ce_k 2.0000000

#define	r_ce_m 2.0000000

#define	r_cg2 2.0000000

#define	r_cg 2.0000000

#define	r_cg_p 2.0000000

#define	r_ch2_w 2.0000000

#define	r_cz2_w 2.0000000

#define	r_cz3_w 2.0000000

#define	r_cz 2.0000000

#define	r_cz_r 2.0000000

#define	r_c 2.0000000

#define	r_nd1_h 1.7500000

#define	r_nd2_n 1.7500000

#define	r_ne1_w 1.7500000

#define	r_ne2_h 1.7500000

#define	r_ne2_q 1.7500000

#define	r_ne_r 1.7500000

#define	r_nh1_r 1.7500000

#define	r_nh2_r 1.7500000

#define	r_nv_p 1.7500000

#define	r_nz_k 1.7500000

#define	r_n 1.7500000

#define	r_od1 1.5500000

#define	r_od2_d 1.5500000

#define	r_oe1 1.5500000

#define	r_oe2_e 1.5500000

#define	r_og 1.5500000

#define	r_oh_y 1.5500000

#define	r_o 1.5500000

#define	r_sd_m 1.9000000

#define	r_sg_c 1.9000000

Enumerations
enum	UATOM { CA , CB , CB_P , CD1 , CD1_W , CD2 , CD2_H , CD2_L , CD2_W , CD , CD_P , CE1 , CE1_H , CE2 , CE2_W , CE3_W , CE_K , CE_M , CG2 , CG , CG_P , CH2_W , CZ2_W , CZ3_W , CZ , CZ_R , C , ND1_H , ND2_N , NE1_W , NE2_H , NE2_Q , NE_R , NH1_R , NH2_R , NV_P , NZ_K , N , OD1 , OD2_D , OE1 , OE2_E , OG , OH_Y , O , SD_M , SG_C , CA , CB , CB_P , CD1 , CD1_W , CD2 , CD2_H , CD2_L , CD2_W , CD , CD_P , CE1 , CE1_H , CE2 , CE2_W , CE3_W , CE_K , CE_M , CG2 , CG , CG_P , CH2_W , CZ2_W , CZ3_W , CZ , CZ_R , C , ND1_H , ND2_N , NE1_W , NE2_H , NE2_Q , NE_R , NH1_R , NH2_R , NV_P , NZ_K , N , OD1 , OD2_D , OE1 , OE2_E , OG , OH_Y , O , SD_M , SG_C }

Macro Definition Documentation

◆ r_c

#define r_c 2.0000000

◆ r_ca

#define r_ca 2.0000000

◆ r_cb

#define r_cb 2.0000000

◆ r_cb_p

#define r_cb_p 2.0000000

◆ r_cd

#define r_cd 2.0000000

◆ r_cd1

#define r_cd1 2.0000000

◆ r_cd1_w

#define r_cd1_w 2.0000000

◆ r_cd2

#define r_cd2 2.0000000

◆ r_cd2_h

#define r_cd2_h 2.0000000

◆ r_cd2_l

#define r_cd2_l 2.0000000

◆ r_cd2_w

#define r_cd2_w 2.0000000

◆ r_cd_p

#define r_cd_p 2.0000000

◆ r_ce1

#define r_ce1 2.0000000

◆ r_ce1_h

#define r_ce1_h 2.0000000

◆ r_ce2

#define r_ce2 2.0000000

◆ r_ce2_w

#define r_ce2_w 2.0000000

◆ r_ce3_w

#define r_ce3_w 2.0000000

◆ r_ce_k

#define r_ce_k 2.0000000

◆ r_ce_m

#define r_ce_m 2.0000000

◆ r_cg

#define r_cg 2.0000000

◆ r_cg2

#define r_cg2 2.0000000

◆ r_cg_p

#define r_cg_p 2.0000000

◆ r_ch2_w

#define r_ch2_w 2.0000000

◆ r_cz

#define r_cz 2.0000000

◆ r_cz2_w

#define r_cz2_w 2.0000000

◆ r_cz3_w

#define r_cz3_w 2.0000000

◆ r_cz_r

#define r_cz_r 2.0000000

◆ r_n

#define r_n 1.7500000

◆ r_nd1_h

#define r_nd1_h 1.7500000

◆ r_nd2_n

#define r_nd2_n 1.7500000

◆ r_ne1_w

#define r_ne1_w 1.7500000

◆ r_ne2_h

#define r_ne2_h 1.7500000

◆ r_ne2_q

#define r_ne2_q 1.7500000

◆ r_ne_r

#define r_ne_r 1.7500000

◆ r_nh1_r

#define r_nh1_r 1.7500000

◆ r_nh2_r

#define r_nh2_r 1.7500000

◆ r_nv_p

#define r_nv_p 1.7500000

◆ r_nz_k

#define r_nz_k 1.7500000

◆ r_o

#define r_o 1.5500000

◆ r_od1

#define r_od1 1.5500000

◆ r_od2_d

#define r_od2_d 1.5500000

◆ r_oe1

#define r_oe1 1.5500000

◆ r_oe2_e

#define r_oe2_e 1.5500000

◆ r_og

#define r_og 1.5500000

◆ r_oh_y

#define r_oh_y 1.5500000

◆ r_sd_m

#define r_sd_m 1.9000000

◆ r_sg_c

#define r_sg_c 1.9000000

◆ x1_c

#define x1_c -2.0462234

◆ x1_ca

#define x1_ca -1.5294880

◆ x1_cb

#define x1_cb 0.0000000

◆ x1_cb_p

#define x1_cb_p -0.0119584

◆ x1_cd

#define x1_cd -0.4783638

◆ x1_cd1

#define x1_cd1 -0.2442786

◆ x1_cd1_w

#define x1_cd1_w -0.0962845

◆ x1_cd2

#define x1_cd2 1.9679581

◆ x1_cd2_h

#define x1_cd2_h 1.8770485

◆ x1_cd2_l

#define x1_cd2_l 1.4893895

◆ x1_cd2_w

#define x1_cd2_w 1.9952924

◆ x1_cd_p

#define x1_cd_p -1.0268733

◆ x1_ce1

#define x1_ce1 0.2943790

◆ x1_ce1_h

#define x1_ce1_h 0.5944039

◆ x1_ce2

#define x1_ce2 2.5065409

◆ x1_ce2_w

#define x1_ce2_w 2.0616894

◆ x1_ce3_w

#define x1_ce3_w 3.1824268

◆ x1_ce_k

#define x1_ce_k -1.8711717

◆ x1_ce_m

#define x1_ce_m -2.1632737

◆ x1_cg

#define x1_cg 0.5915642

◆ x1_cg2

#define x1_cg2 0.5326465

◆ x1_cg_p

#define x1_cg_p 0.1567080

◆ x1_ch2_w

#define x1_ch2_w 4.4375384

◆ x1_cz

#define x1_cz 1.6750406

◆ x1_cz2_w

#define x1_cz2_w 3.2711149

◆ x1_cz3_w

#define x1_cz3_w 4.3952531

◆ x1_cz_r

#define x1_cz_r -2.0808292

◆ x1_n

#define x1_n -2.0400342

◆ x1_nd1_h

#define x1_nd1_h -0.1880577

◆ x1_nd2_n

#define x1_nd2_n 1.8976920

◆ x1_ne1_w

#define x1_ne1_w 0.7775292

◆ x1_ne2_h

#define x1_ne2_h 1.8507970

◆ x1_ne2_q

#define x1_ne2_q -0.0574527

◆ x1_ne_r

#define x1_ne_r -1.8147512

◆ x1_nh1_r

#define x1_nh1_r -1.0945695

◆ x1_nh2_r

#define x1_nh2_r -3.3333551

◆ x1_nv_p

#define x1_nv_p -2.0181350

◆ x1_nz_k

#define x1_nz_k -1.8249921

◆ x1_o

#define x1_o -2.3056024

◆ x1_od1

#define x1_od1 -0.1517762

◆ x1_od2_d

#define x1_od2_d 1.7939259

◆ x1_oe1

#define x1_oe1 -1.6545054

◆ x1_oe2_e

#define x1_oe2_e -0.1345519

◆ x1_og

#define x1_og 0.5021427

◆ x1_oh_y

#define x1_oh_y 2.2115206

◆ x1_sd_m

#define x1_sd_m -0.6700778

◆ x1_sg_c

#define x1_sg_c 0.7385894

◆ x2_c

#define x2_c -1.5172358

◆ x2_ca

#define x2_ca -0.5963369

◆ x2_cb

#define x2_cb -0.0000000

◆ x2_cb_p

#define x2_cb_p 0.1789471

◆ x2_cd

#define x2_cd 2.0815779

◆ x2_cd1

#define x2_cd1 2.2108445

◆ x2_cd1_w

#define x2_cd1_w 2.3323410

◆ x2_cd2

#define x2_cd2 2.2106900

◆ x2_cd2_h

#define x2_cd2_h 2.4090189

◆ x2_cd2_l

#define x2_cd2_l 2.0251100

◆ x2_cd2_w

#define x2_cd2_w 2.3925496

◆ x2_cd_p

#define x2_cd_p 1.7278786

◆ x2_ce1

#define x2_ce1 3.5923965

◆ x2_ce1_h

#define x2_ce1_h 3.5471396

◆ x2_ce2

#define x2_ce2 3.5920500

◆ x2_ce2_w

#define x2_ce2_w 3.7037366

◆ x2_ce3_w

#define x2_ce3_w 2.1713794

◆ x2_ce_k

#define x2_ce_k 0.9743982

◆ x2_ce_m

#define x2_ce_m 0.7206807

◆ x2_cg

#define x2_cg 1.5172470

◆ x2_cg2

#define x2_cg2 -0.4799299

◆ x2_cg_p

#define x2_cg_p 1.4206848

◆ x2_ch2_w

#define x2_ch2_w 4.5487107

◆ x2_cz

#define x2_cz 4.2820440

◆ x2_cz2_w

#define x2_cz2_w 4.7985800

◆ x2_cz3_w

#define x2_cz3_w 3.2693045

◆ x2_cz_r

#define x2_cz_r -0.2871352

◆ x2_n

#define x2_n 0.4622142

◆ x2_nd1_h

#define x2_nd1_h 2.2609087

◆ x2_nd2_n

#define x2_nd2_n 2.1011602

◆ x2_ne1_w

#define x2_ne1_w 3.6481941

◆ x2_ne2_h

#define x2_ne2_h 3.6630869

◆ x2_ne2_q

#define x2_ne2_q 3.4056457

◆ x2_ne_r

#define x2_ne_r 1.0328361

◆ x2_nh1_r

#define x2_nh1_r -0.7030185

◆ x2_nh2_r

#define x2_nh2_r -1.1638662

◆ x2_nv_p

#define x2_nv_p 0.4047081

◆ x2_nz_k

#define x2_nz_k -0.3772760

◆ x2_o

#define x2_o -1.0924196

◆ x2_od1

#define x2_od1 2.1209516

◆ x2_od2_d

#define x2_od2_d 2.0910957

◆ x2_oe1

#define x2_oe1 1.3244862

◆ x2_oe2_e

#define x2_oe2_e 3.2825415

◆ x2_og

#define x2_og 1.4003816

◆ x2_oh_y

#define x2_oh_y 5.6580058

◆ x2_sd_m

#define x2_sd_m 2.2125427

◆ x2_sg_c

#define x2_sg_c 1.8084373

◆ y1_c

#define y1_c -0.7812559

◆ y1_ca

#define y1_ca 0.0000000

◆ y1_cb

#define y1_cb -0.0000000

◆ y1_cb_p

#define y1_cb_p 0.1993893

◆ y1_cd

#define y1_cd 2.4630111

◆ y1_cd1

#define y1_cd1 2.5042751

◆ y1_cd1_w

#define y1_cd1_w 2.5735523

◆ y1_cd2

#define y1_cd2 1.5674440

◆ y1_cd2_h

#define y1_cd2_h 1.8213088

◆ y1_cd2_l

#define y1_cd2_l 1.5685415

◆ y1_cd2_w

#define y1_cd2_w 1.7533594

◆ y1_cd_p

#define y1_cd_p 2.3111539

◆ y1_ce1

#define y1_ce1 3.7764912

◆ y1_ce1_h

#define y1_ce1_h 3.6003141

◆ y1_ce2

#define y1_ce2 2.8394833

◆ y1_ce2_w

#define y1_ce2_w 3.1491190

◆ y1_ce3_w

#define y1_ce3_w 1.0105477

◆ y1_ce_k

#define y1_ce_k 1.8503952

◆ y1_ce_m

#define y1_ce_m 1.6985493

◆ y1_cg

#define y1_cg 1.3971722

◆ y1_cg2

#define y1_cg2 -0.7466988

◆ y1_cg_p

#define y1_cg_p 1.4764299

◆ y1_ch2_w

#define y1_ch2_w 3.0607742

◆ y1_cz

#define y1_cz 3.9408344

◆ y1_cz2_w

#define y1_cz2_w 3.8259826

◆ y1_cz3_w

#define y1_cz3_w 1.6893180

◆ y1_cz_r

#define y1_cz_r 0.5692133

◆ y1_n

#define y1_n 1.3656901

◆ y1_nd1_h

#define y1_nd1_h 2.5348379

◆ y1_nd2_n

#define y1_nd2_n 1.4782518

◆ y1_ne1_w

#define y1_ne1_w 3.6325178

◆ y1_ne2_h

#define y1_ne2_h 3.1942679

◆ y1_ne2_q

#define y1_ne2_q 3.7226568

◆ y1_ne_r

#define y1_ne_r 1.8899669

◆ y1_nh1_r

#define y1_nh1_r -0.2999949

◆ y1_nh2_r

#define y1_nh2_r 0.1474556

◆ y1_nv_p

#define y1_nv_p 1.2939697

◆ y1_nz_k

#define y1_nz_k 0.3630040

◆ y1_o

#define y1_o -0.2101090

◆ y1_od1

#define y1_od1 2.3674910

◆ y1_od2_d

#define y1_od2_d 1.5112570

◆ y1_oe1

#define y1_oe1 2.1388335

◆ y1_oe2_e

#define y1_oe2_e 3.6216168

◆ y1_og

#define y1_og 1.3081245

◆ y1_oh_y

#define y1_oh_y 5.2079019

◆ y1_sd_m

#define y1_sd_m 2.6864031

◆ y1_sg_c

#define y1_sg_c 1.6511372

◆ y2_c

#define y2_c 1.5796792

◆ y2_ca

#define y2_ca 1.4084445

◆ y2_cb

#define y2_cb 0.0000000

◆ y2_cb_p

#define y2_cb_p 0.0887525

◆ y2_cd

#define y2_cd 1.4008173

◆ y2_cd1

#define y2_cd1 1.2013461

◆ y2_cd1_w

#define y2_cd1_w 1.0920749

◆ y2_cd2

#define y2_cd2 -1.2010785

◆ y2_cd2_h

#define y2_cd2_h -1.0183833

◆ y2_cd2_l

#define y2_cd2_l -0.7599558

◆ y2_cd2_w

#define y2_cd2_w -1.1537624

◆ y2_cd_p

#define y2_cd_p 1.8467097

◆ y2_ce1

#define y2_ce1 1.2013461

◆ y2_ce1_h

#define y2_ce1_h 0.8563749

◆ y2_ce2

#define y2_ce2 -1.2010785

◆ y2_ce2_w

#define y2_ce2_w -0.6707077

◆ y2_ce3_w

#define y2_ce3_w -2.5365643

◆ y2_ce_k

#define y2_ce_k 2.4445438

◆ y2_ce_m

#define y2_ce_m 2.6543252

◆ y2_cg

#define y2_cg 0.0000000

◆ y2_cg2

#define y2_cg2 -0.7816257

◆ y2_cg_p

#define y2_cg_p 0.4313438

◆ y2_ch2_w

#define y2_ch2_w -2.8929773

◆ y2_cz

#define y2_cz -0.0059738

◆ y2_cz2_w

#define y2_cz2_w -1.5205149

◆ y2_cz3_w

#define y2_cz3_w -3.3887598

◆ y2_cz_r

#define y2_cz_r 2.1380849

◆ y2_n

#define y2_n 2.4110593

◆ y2_nd1_h

#define y2_nd1_h 1.1614907

◆ y2_nd2_n

#define y2_nd2_n -1.1711487

◆ y2_ne1_w

#define y2_ne1_w 0.7002982

◆ y2_ne2_h

#define y2_ne2_h -0.4589020

◆ y2_ne2_q

#define y2_ne2_q 1.5043442

◆ y2_ne_r

#define y2_ne_r 2.4080171

◆ y2_nh1_r

#define y2_nh1_r 0.8909794

◆ y2_nh2_r

#define y2_nh2_r 3.1270457

◆ y2_nv_p

#define y2_nv_p 2.3629299

◆ y2_nz_k

#define y2_nz_k 1.8220952

◆ y2_o

#define y2_o 2.0412172

◆ y2_od1

#define y2_od1 1.0628332

◆ y2_od2_d

#define y2_od2_d -1.0627261

◆ y2_oe1

#define y2_oe1 2.3574845

◆ y2_oe2_e

#define y2_oe2_e 1.5359470

◆ y2_og

#define y2_og 0.0476256

◆ y2_oh_y

#define y2_oh_y -0.0059759

◆ y2_sd_m

#define y2_sd_m 1.6644581

◆ y2_sg_c

#define y2_sg_c -0.0363704

◆ z1_c

#define z1_c 1.2012238

◆ z1_ca

#define z1_ca 0.0000000

◆ z1_cb

#define z1_cb 0.0000000

◆ z1_cb_p

#define z1_cb_p 0.0661247

◆ z1_cd

#define z1_cd 0.0000007

◆ z1_cd1

#define z1_cd1 0.0000000

◆ z1_cd1_w

#define z1_cd1_w 0.0000028

◆ z1_cd2

#define z1_cd2 0.0000000

◆ z1_cd2_h

#define z1_cd2_h -0.0009351

◆ z1_cd2_l

#define z1_cd2_l 1.2162614

◆ z1_cd2_w

#define z1_cd2_w 0.0008309

◆ z1_cd_p

#define z1_cd_p 0.4052198

◆ z1_ce1

#define z1_ce1 0.0000000

◆ z1_ce1_h

#define z1_ce1_h 0.0000084

◆ z1_ce2

#define z1_ce2 0.0000000

◆ z1_ce2_w

#define z1_ce2_w 0.0013971

◆ z1_ce3_w

#define z1_ce3_w 0.0019356

◆ z1_ce_k

#define z1_ce_k 0.0000013

◆ z1_ce_m

#define z1_ce_m 0.0000004

◆ z1_cg

#define z1_cg 0.0000000

◆ z1_cg2

#define z1_cg2 -1.2132623

◆ z1_cg_p

#define z1_cg_p 0.8161961

◆ z1_ch2_w

#define z1_ch2_w 0.0029114

◆ z1_cz

#define z1_cz 0.0000000

◆ z1_cz2_w

#define z1_cz2_w 0.0008706

◆ z1_cz3_w

#define z1_cz3_w 0.0027443

◆ z1_cz_r

#define z1_cz_r 0.0000010

◆ z1_n

#define z1_n 0.0000000

◆ z1_nd1_h

#define z1_nd1_h 0.0000002

◆ z1_nd2_n

#define z1_nd2_n 0.0000000

◆ z1_ne1_w

#define z1_ne1_w -0.0006771

◆ z1_ne2_h

#define z1_ne2_h -0.0009374

◆ z1_ne2_q

#define z1_ne2_q 0.0000007

◆ z1_ne_r

#define z1_ne_r 0.0000011

◆ z1_nh1_r

#define z1_nh1_r 0.0000004

◆ z1_nh2_r

#define z1_nh2_r 0.0000015

◆ z1_nv_p

#define z1_nv_p 0.0057931

◆ z1_nz_k

#define z1_nz_k 0.0000008

◆ z1_o

#define z1_o 2.2604272

◆ z1_od1

#define z1_od1 0.0000000

◆ z1_od2_d

#define z1_od2_d 0.0000000

◆ z1_oe1

#define z1_oe1 0.0000011

◆ z1_oe2_e

#define z1_oe2_e 0.0000007

◆ z1_og

#define z1_og 0.0000000

◆ z1_oh_y

#define z1_oh_y 0.0000000

◆ z1_sd_m

#define z1_sd_m 0.0000009

◆ z1_sg_c

#define z1_sg_c 0.0000000

◆ z2_c

#define z2_c 1.2012238

◆ z2_ca

#define z2_ca 0.0000000

◆ z2_cb

#define z2_cb 0.0000000

◆ z2_cb_p

#define z2_cb_p 0.0661247

◆ z2_cd

#define z2_cd 0.0000007

◆ z2_cd1

#define z2_cd1 0.0000000

◆ z2_cd1_w

#define z2_cd1_w 0.0000028

◆ z2_cd2

#define z2_cd2 0.0000000

◆ z2_cd2_h

#define z2_cd2_h -0.0009351

◆ z2_cd2_l

#define z2_cd2_l 1.2162614

◆ z2_cd2_w

#define z2_cd2_w 0.0008309

◆ z2_cd_p

#define z2_cd_p 0.4052198

◆ z2_ce1

#define z2_ce1 0.0000000

◆ z2_ce1_h

#define z2_ce1_h 0.0000084

◆ z2_ce2

#define z2_ce2 0.0000000

◆ z2_ce2_w

#define z2_ce2_w 0.0013971

◆ z2_ce3_w

#define z2_ce3_w 0.0019356

◆ z2_ce_k

#define z2_ce_k 0.0000013

◆ z2_ce_m

#define z2_ce_m 0.0000004

◆ z2_cg

#define z2_cg 0.0000000

◆ z2_cg2

#define z2_cg2 -1.2132623

◆ z2_cg_p

#define z2_cg_p 0.8161961

◆ z2_ch2_w

#define z2_ch2_w 0.0029114

◆ z2_cz

#define z2_cz 0.0000000

◆ z2_cz2_w

#define z2_cz2_w 0.0008706

◆ z2_cz3_w

#define z2_cz3_w 0.0027443

◆ z2_cz_r

#define z2_cz_r 0.0000010

◆ z2_n

#define z2_n 0.0000000

◆ z2_nd1_h

#define z2_nd1_h 0.0000002

◆ z2_nd2_n

#define z2_nd2_n 0.0000000

◆ z2_ne1_w

#define z2_ne1_w -0.0006771

◆ z2_ne2_h

#define z2_ne2_h -0.0009374

◆ z2_ne2_q

#define z2_ne2_q 0.0000007

◆ z2_ne_r

#define z2_ne_r 0.0000011

◆ z2_nh1_r

#define z2_nh1_r 0.0000004

◆ z2_nh2_r

#define z2_nh2_r 0.0000015

◆ z2_nv_p

#define z2_nv_p 0.0057931

◆ z2_nz_k

#define z2_nz_k 0.0000008

◆ z2_o

#define z2_o 2.2604272

◆ z2_od1

#define z2_od1 0.0000000

◆ z2_od2_d

#define z2_od2_d 0.0000000

◆ z2_oe1

#define z2_oe1 0.0000011

◆ z2_oe2_e

#define z2_oe2_e 0.0000007

◆ z2_og

#define z2_og 0.0000000

◆ z2_oh_y

#define z2_oh_y 0.0000000

◆ z2_sd_m

#define z2_sd_m 0.0000009

◆ z2_sg_c

#define z2_sg_c 0.0000000

Enumeration Type Documentation

◆ UATOM

enum UATOM

Enumerator
CA
CB
CB_P
CD1
CD1_W
CD2
CD2_H
CD2_L
CD2_W
CD
CD_P
CE1
CE1_H
CE2
CE2_W
CE3_W
CE_K
CE_M
CG2
CG
CG_P
CH2_W
CZ2_W
CZ3_W
CZ
CZ_R
C
ND1_H
ND2_N
NE1_W
NE2_H
NE2_Q
NE_R
NH1_R
NH2_R
NV_P
NZ_K
N
OD1
OD2_D
OE1
OE2_E
OG
OH_Y
O
SD_M
SG_C
CA
CB
CB_P
CD1
CD1_W
CD2
CD2_H
CD2_L
CD2_W
CD
CD_P
CE1
CE1_H
CE2
CE2_W
CE3_W
CE_K
CE_M
CG2
CG
CG_P
CH2_W
CZ2_W
CZ3_W
CZ
CZ_R
C
ND1_H
ND2_N
NE1_W
NE2_H
NE2_Q
NE_R
NH1_R
NH2_R
NV_P
NZ_K
N
OD1
OD2_D
OE1
OE2_E
OG
OH_Y
O
SD_M
SG_C

Macros

Enumerations