blob: b46f56266c967c5a169168844e9e78645c57bb3d (
plain)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
|
Br-Se-Br theta0= 1.8099903686 Ktheta= 0.800201373458 CenterHybridization= sp3
Br-Se-Cl theta0= 1.7948054055 Ktheta= 0.837979113404 CenterHybridization= sp3
Br-Se-F theta0= 1.7537627734 Ktheta= 0.754449676831 CenterHybridization= sp3
Br-Se-H theta0= 1.6371900843 Ktheta= 0.717590002324 CenterHybridization= sp3
Cl-Se-Cl theta0= 1.7808858986 Ktheta= 0.874902294409 CenterHybridization= sp3
Cl-Se-F theta0= 1.7434207377 Ktheta= 0.855697792875 CenterHybridization= sp3
Cl-Se-H theta0= 1.6373969408 Ktheta= 0.804279262138 CenterHybridization= sp3
F-Se-F theta0= 1.6778568161 Ktheta= 0.980778002661 CenterHybridization= sp3
F-Se-H theta0= 1.6396818193 Ktheta= 0.895707074058 CenterHybridization= sp3
As-Se-As theta0= 1.7620134789 Ktheta= 0.714745169158 CenterHybridization= sp3
As-Se-Br theta0= 1.8280662026 Ktheta= 0.732747192454 CenterHybridization= sp3
As-Se-Cl theta0= 1.8189890646 Ktheta= 0.739201593235 CenterHybridization= sp3
As-Se-F theta0= 1.8059322949 Ktheta= 0.670476090429 CenterHybridization= sp3
As-Se-H theta0= 1.6747543415 Ktheta= 0.498055331245 CenterHybridization= sp3
As-Se-O theta0= 1.6864410662 Ktheta= 0.787699567745 CenterHybridization= sp3
As-Se-P theta0= 1.7717997110 Ktheta= 0.764400730298 CenterHybridization= sp3
As-Se-S theta0= 1.7270439974 Ktheta= 0.762350542758 CenterHybridization= sp3
As-Se-Se theta0= 1.7307545011 Ktheta= 0.736610075733 CenterHybridization= sp3
N-Se-As theta0= 1.8873572747 Ktheta= 0.740163356597 CenterHybridization= sp3
N-Se-Br theta0= 1.8548064270 Ktheta= 0.775176225641 CenterHybridization= sp3
N-Se-Cl theta0= 1.8504712892 Ktheta= 0.814895979942 CenterHybridization= sp3
N-Se-F theta0= 1.8122470183 Ktheta= 0.854999246773 CenterHybridization= sp3
N-Se-H theta0= 1.7591377121 Ktheta= 0.906059054593 CenterHybridization= sp3
N-Se-N theta0= 1.9185276474 Ktheta= 0.982207665250 CenterHybridization= sp3
N-Se-O theta0= 1.7289432420 Ktheta= 1.008652876385 CenterHybridization= sp3
N-Se-P theta0= 1.7685729446 Ktheta= 0.892565469760 CenterHybridization= sp3
N-Se-S theta0= 1.7794867554 Ktheta= 0.861552962406 CenterHybridization= sp3
N-Se-Se theta0= 1.7721911255 Ktheta= 0.844695691098 CenterHybridization= sp3
P-Se-Br theta0= 1.8482074784 Ktheta= 0.775446368046 CenterHybridization= sp3
P-Se-Cl theta0= 1.8315937556 Ktheta= 0.799783024901 CenterHybridization= sp3
P-Se-F theta0= 1.8053016742 Ktheta= 0.775482851106 CenterHybridization= sp3
P-Se-H theta0= 1.7010725191 Ktheta= 0.655962314011 CenterHybridization= sp3
P-Se-O theta0= 1.7230365068 Ktheta= 0.836298483378 CenterHybridization= sp3
P-Se-P theta0= 1.7809848710 Ktheta= 0.823411825643 CenterHybridization= sp3
P-Se-S theta0= 1.7453338559 Ktheta= 0.816883247410 CenterHybridization= sp3
P-Se-Se theta0= 1.7487926482 Ktheta= 0.761857970982 CenterHybridization= sp3
C-Se-As theta0= 1.7655471912 Ktheta= 0.793648611689 CenterHybridization= sp3
C-Se-Br theta0= 1.7223878936 Ktheta= 0.917653401154 CenterHybridization= sp3
C-Se-C theta0= 1.7132420210 Ktheta= 0.975554208112 CenterHybridization= sp3
C-Se-Cl theta0= 1.6958230015 Ktheta= 0.981374379867 CenterHybridization= sp3
C-Se-F theta0= 1.6752331918 Ktheta= 1.024745531632 CenterHybridization= sp3
C-Se-H theta0= 1.6612506506 Ktheta= 0.815969676807 CenterHybridization= sp3
C-Se-N theta0= 1.7973856200 Ktheta= 0.978389887797 CenterHybridization= sp3
C-Se-O theta0= 1.6122555549 Ktheta= 1.068384624960 CenterHybridization= sp3
C-Se-P theta0= 1.7607280648 Ktheta= 0.866536022127 CenterHybridization= sp3
C-Se-S theta0= 1.6535273103 Ktheta= 0.945308032511 CenterHybridization= sp3
C-Se-Se theta0= 1.6625586352 Ktheta= 0.874853901763 CenterHybridization= sp3
Ge-Se-As theta0= 1.7341363924 Ktheta= 0.667555879155 CenterHybridization= sp3
Ge-Se-Br theta0= 1.6957375275 Ktheta= 0.622362081549 CenterHybridization= sp3
Ge-Se-C theta0= 1.7115991705 Ktheta= 0.676515511619 CenterHybridization= sp3
Ge-Se-Cl theta0= 1.6917358785 Ktheta= 0.654262865637 CenterHybridization= sp3
Ge-Se-F theta0= 1.6831777787 Ktheta= 0.567327151059 CenterHybridization= sp3
Ge-Se-Ge theta0= 1.7005526640 Ktheta= 0.566262079022 CenterHybridization= sp3
Ge-Se-H theta0= 1.6048063623 Ktheta= 0.556165922522 CenterHybridization= sp3
Ge-Se-N theta0= 1.7930040337 Ktheta= 0.657412943535 CenterHybridization= sp3
Ge-Se-O theta0= 1.5883405614 Ktheta= 0.722275758475 CenterHybridization= sp3
Ge-Se-P theta0= 1.7353448602 Ktheta= 0.722535837405 CenterHybridization= sp3
Ge-Se-S theta0= 1.6700938848 Ktheta= 0.694043931670 CenterHybridization= sp3
Ge-Se-Se theta0= 1.6597660194 Ktheta= 0.697368292402 CenterHybridization= sp3
Ge-Se-Si theta0= 1.6922260822 Ktheta= 0.585535210180 CenterHybridization= sp3
Si-Se-As theta0= 1.7216640846 Ktheta= 0.703131617483 CenterHybridization= sp3
Si-Se-Br theta0= 1.6955644066 Ktheta= 0.622993135800 CenterHybridization= sp3
Si-Se-C theta0= 1.6963139417 Ktheta= 0.711081127122 CenterHybridization= sp3
Si-Se-Cl theta0= 1.6968172475 Ktheta= 0.632170832769 CenterHybridization= sp3
Si-Se-F theta0= 1.6789373372 Ktheta= 0.642715524911 CenterHybridization= sp3
Si-Se-H theta0= 1.6149755092 Ktheta= 0.589634109881 CenterHybridization= sp3
Si-Se-N theta0= 1.7840855775 Ktheta= 0.689592154157 CenterHybridization= sp3
Si-Se-O theta0= 1.6062989120 Ktheta= 0.639429517707 CenterHybridization= sp3
Si-Se-P theta0= 1.7288677339 Ktheta= 0.694700905910 CenterHybridization= sp3
Si-Se-S theta0= 1.6678721767 Ktheta= 0.691767839121 CenterHybridization= sp3
Si-Se-Se theta0= 1.6610246112 Ktheta= 0.685736678852 CenterHybridization= sp3
Si-Se-Si theta0= 1.6859560409 Ktheta= 0.583960570712 CenterHybridization= sp3
O-Se-Br theta0= 1.7625386764 Ktheta= 0.916280421139 CenterHybridization= sp3
O-Se-Cl theta0= 1.7492129776 Ktheta= 0.921278226551 CenterHybridization= sp3
O-Se-F theta0= 1.7068046638 Ktheta= 0.967349127087 CenterHybridization= sp3
O-Se-H theta0= 1.5890292072 Ktheta= 0.900913861704 CenterHybridization= sp3
O-Se-O theta0= 1.6127471461 Ktheta= 1.166395765984 CenterHybridization= sp3
O-Se-S theta0= 1.5636522927 Ktheta= 1.023122509586 CenterHybridization= sp3
O-Se-Se theta0= 1.5631724825 Ktheta= 0.948167931868 CenterHybridization= sp3
S-Se-Br theta0= 1.6868021678 Ktheta= 0.866437815740 CenterHybridization= sp3
S-Se-Cl theta0= 1.6756728769 Ktheta= 0.922869265084 CenterHybridization= sp3
S-Se-F theta0= 1.6545104002 Ktheta= 0.864040730906 CenterHybridization= sp3
S-Se-H theta0= 1.5902364305 Ktheta= 0.777424597427 CenterHybridization= sp3
S-Se-S theta0= 1.6186527015 Ktheta= 0.971092568188 CenterHybridization= sp3
S-Se-Se theta0= 1.6306159509 Ktheta= 0.861247466408 CenterHybridization= sp3
Se-Se-Br theta0= 1.6856112476 Ktheta= 0.801326672048 CenterHybridization= sp3
Se-Se-Cl theta0= 1.6773737369 Ktheta= 0.836693984697 CenterHybridization= sp3
Se-Se-F theta0= 1.6352197001 Ktheta= 0.786956074222 CenterHybridization= sp3
Se-Se-H theta0= 1.5835007669 Ktheta= 0.704066918675 CenterHybridization= sp3
Se-Se-Se theta0= 1.6339607871 Ktheta= 0.842129258674 CenterHybridization= sp3
Se-Se-H theta0= 1.5945010832 Ktheta= 0.745086981847 CenterHybridization= sp3
Al-Se-Al theta0= 1.7171068379 Ktheta= 0.771669621219 CenterHybridization= sp3
Al-Se-As theta0= 1.7751028828 Ktheta= 0.701057998881 CenterHybridization= sp3
Al-Se-B theta0= 1.7098056388 Ktheta= 0.695637370269 CenterHybridization= sp3
Al-Se-Br theta0= 1.7230785308 Ktheta= 0.659260325182 CenterHybridization= sp3
Al-Se-Cl theta0= 1.7213168548 Ktheta= 0.649080793873 CenterHybridization= sp3
Al-Se-F theta0= 1.7135596168 Ktheta= 0.545078919418 CenterHybridization= sp3
Al-Se-H theta0= 1.5946070840 Ktheta= 0.433139516773 CenterHybridization= sp3
Al-Se-N theta0= 1.6869505924 Ktheta= 0.522479624156 CenterHybridization= sp3
Al-Se-O theta0= 1.7095361861 Ktheta= 0.563863542642 CenterHybridization= sp3
Al-Se-P theta0= 1.7930330114 Ktheta= 0.659117858123 CenterHybridization= sp3
Al-Se-S theta0= 1.7030950991 Ktheta= 0.640087209491 CenterHybridization= sp3
Al-Se-Se theta0= 1.7057287346 Ktheta= 0.605139957032 CenterHybridization= sp3
B-Se-As theta0= 1.8268000989 Ktheta= 0.818425742501 CenterHybridization= sp3
B-Se-B theta0= 1.7739802818 Ktheta= 0.968923432694 CenterHybridization= sp3
B-Se-Br theta0= 1.8108743849 Ktheta= 0.925331310949 CenterHybridization= sp3
B-Se-Cl theta0= 1.8075543794 Ktheta= 0.937108171866 CenterHybridization= sp3
B-Se-F theta0= 1.7943973929 Ktheta= 0.975046988432 CenterHybridization= sp3
B-Se-H theta0= 1.6981053668 Ktheta= 0.730446361599 CenterHybridization= sp3
B-Se-N theta0= 1.7569372271 Ktheta= 1.048837144298 CenterHybridization= sp3
B-Se-O theta0= 1.7541157087 Ktheta= 0.997300395089 CenterHybridization= sp3
B-Se-P theta0= 1.3734014578 Ktheta= 0.912988530436 CenterHybridization= sp3
B-Se-S theta0= 1.7708627031 Ktheta= 0.846091927548 CenterHybridization= sp3
B-Se-Se theta0= 1.7648186890 Ktheta= 0.810445276708 CenterHybridization= sp3
Ga-Se-Al theta0= 1.7120527397 Ktheta= 0.825283759703 CenterHybridization= sp3
Ga-Se-As theta0= 1.7992553807 Ktheta= 0.697228660842 CenterHybridization= sp3
Ga-Se-B theta0= 1.7346786959 Ktheta= 0.793806258974 CenterHybridization= sp3
Ga-Se-Br theta0= 1.7494649578 Ktheta= 0.718374792090 CenterHybridization= sp3
Ga-Se-Cl theta0= 1.7472792139 Ktheta= 0.679722881500 CenterHybridization= sp3
Ga-Se-F theta0= 1.7325383428 Ktheta= 0.605875770285 CenterHybridization= sp3
Ga-Se-Ga theta0= 1.7100386332 Ktheta= 0.901288277958 CenterHybridization= sp3
Ga-Se-H theta0= 1.6354786878 Ktheta= 0.453227886518 CenterHybridization= sp3
Ga-Se-N theta0= 1.7093128468 Ktheta= 0.635547028286 CenterHybridization= sp3
Ga-Se-O theta0= 1.7198242702 Ktheta= 0.592724064764 CenterHybridization= sp3
Ga-Se-P theta0= 1.7216506491 Ktheta= 0.707831652527 CenterHybridization= sp3
Ga-Se-S theta0= 1.7124622219 Ktheta= 0.654444670344 CenterHybridization= sp3
Ga-Se-Se theta0= 1.7157583512 Ktheta= 0.650587492384 CenterHybridization= sp3
C-Se-Al theta0= 1.7458029184 Ktheta= 0.588366618952 CenterHybridization= sp3
C-Se-B theta0= 1.7777940496 Ktheta= 0.928948496067 CenterHybridization= sp3
C-Se-Ga theta0= 1.7647142066 Ktheta= 0.630481242374 CenterHybridization= sp3
Ge-Se-Al theta0= 1.7155323625 Ktheta= 0.555794211317 CenterHybridization= sp3
Ge-Se-B theta0= 1.7473116857 Ktheta= 0.660308587476 CenterHybridization= sp3
Ge-Se-Ga theta0= 1.7285327441 Ktheta= 0.569030040135 CenterHybridization= sp3
Si-Se-Al theta0= 1.7211054693 Ktheta= 0.526494725127 CenterHybridization= sp3
Si-Se-B theta0= 1.7254952167 Ktheta= 0.651394254420 CenterHybridization= sp3
Si-Se-Ga theta0= 1.7358693997 Ktheta= 0.542117180605 CenterHybridization= sp3
|
