0 mol 9 unq 0 iso 0 dist 8.57077 5.8245 5.84314 8.55451 8.69454 3.58336 8.27962 6.85412 9.71516 13.2602 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.57077 5.8245 5.84314 8.55451 8.69454 3.58336 11.4878 6.33889 9.81658 12.6418 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 5.04899 9.49421 13.6145 7.52933 5.03027 16.0628 4.70708 9.43699 8.53931 11.598 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 5.04899 9.49421 13.6145 6.55597 4.69295 12.1732 4.70708 9.43699 8.53931 11.1095 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 5.04899 9.49421 13.6145 9.71956 12.2542 8.99147 4.70708 9.43699 8.53931 11.6083 numMergedOcc 0
5 mol 25 unq 3 iso 0 dist 5.04899 9.49421 13.6145 7.07751 8.79309 9.54872 4.70708 9.43699 8.53931 10.1706 numMergedOcc 0
6 mol 25 unq 4 iso 0 dist 5.04899 9.49421 13.6145 8.23761 8.17061 14.6175 4.70708 9.43699 8.53931 11.6932 numMergedOcc 0
7 mol 25 unq 5 iso 0 dist 7.57578 9.48085 5.18617 4.79873 10.2864 12.7147 12.1492 12.8446 8.53931 15.056 numMergedOcc 0
8 mol 25 unq 6 iso 0 dist 7.17969 9.48085 5.68041 4.79873 11.4148 12.7147 12.1492 11.7303 8.53931 15.056 numMergedOcc 0
9 mol 72 unq 0 iso 0 dist 9.96708 9.55118 5.69391 9.10345 13.4212 9.20237 7.11552 6.77912 5.4605 10.8476 numMergedOcc 0
10 mol 72 unq 1 iso 0 dist 9.96708 9.55118 5.69391 9.10345 13.4212 9.20237 12.3903 10.4226 6.1906 11.5204 numMergedOcc 0
11 mol 72 unq 2 iso 0 dist 9.96708 9.55118 5.69391 9.10345 13.4212 9.20237 7.17489 10.4676 6.7272 7.64009 numMergedOcc 0
12 mol 72 unq 3 iso 0 dist 9.96708 9.10345 13.4212 9.55118 5.69391 9.20237 7.17489 10.4676 7.64009 6.7272 numMergedOcc 0
13 mol 72 unq 4 iso 0 dist 9.78528 6.21799 7.47371 5.03251 9.67587 3.43675 6.11922 7.321 9.14817 9.76686 numMergedOcc 0
14 mol 72 unq 5 iso 0 dist 9.78528 6.21799 7.47371 7.66093 7.07356 5.75711 6.11922 7.321 9.14817 9.437 numMergedOcc 0
15 mol 72 unq 6 iso 0 dist 9.78528 5.03251 9.67587 6.21799 7.47371 3.43675 6.11922 7.321 9.76686 9.14817 numMergedOcc 0
16 mol 72 unq 7 iso 0 dist 9.78528 5.03251 9.67587 7.66093 7.07356 5.26077 6.11922 7.321 9.76686 9.437 numMergedOcc 0
17 mol 72 unq 8 iso 0 dist 9.78528 7.66093 7.07356 6.21799 7.47371 5.75711 6.11922 7.321 9.437 9.14817 numMergedOcc 0
18 mol 72 unq 9 iso 0 dist 9.78528 7.66093 7.07356 5.03251 9.67587 5.26077 6.11922 7.321 9.437 9.76686 numMergedOcc 0
19 mol 72 unq 10 iso 0 dist 9.78528 9.55118 9.78221 9.10345 11.6634 9.20237 7.11552 11.9814 5.4605 10.8476 numMergedOcc 0
20 mol 72 unq 11 iso 0 dist 9.78528 9.55118 9.78221 9.10345 11.6634 9.20237 12.3903 15.7961 6.1906 11.5204 numMergedOcc 0
21 mol 72 unq 12 iso 0 dist 9.78528 9.55118 9.78221 9.10345 11.6634 9.20237 7.17489 13.3943 6.7272 7.64009 numMergedOcc 0
22 mol 72 unq 13 iso 0 dist 9.78528 9.10345 11.6634 9.55118 9.78221 9.20237 7.17489 13.3943 7.64009 6.7272 numMergedOcc 0
23 mol 98 unq 0 iso 0 dist 6.48948 5.92242 3.9764 7.02507 7.03983 9.6331 9.74284 10.417 6.61111 14.6927 numMergedOcc 0
24 mol 98 unq 1 iso 0 dist 6.10456 7.54889 10.4782 5.2571 3.9764 6.70343 10.0962 10.417 4.44979 6.61111 numMergedOcc 0
25 mol 98 unq 2 iso 0 dist 6.10456 5.2571 3.9764 7.54889 10.4782 6.70343 10.0962 10.417 6.61111 4.44979 numMergedOcc 0
26 mol 115 unq 0 iso 0 dist 7.30858 9.42082 15.3161 7.69765 10.3209 11.044 10.9739 17.6696 8.0168 10.1174 numMergedOcc 0
27 mol 115 unq 1 iso 0 dist 5.83991 9.42082 6.63111 7.69765 4.48636 11.044 10.9739 7.76729 8.0168 10.1174 numMergedOcc 0
28 mol 115 unq 2 iso 0 dist 7.88312 9.42082 6.07067 7.69765 11.835 11.044 10.9739 12.9821 8.0168 10.1174 numMergedOcc 0
29 mol 134 unq 0 iso 0 dist 9.86662 9.1998 12.8086 8.69531 7.41373 5.83782 6.74887 11.2292 6.44575 7.43401 numMergedOcc 0
30 mol 134 unq 1 iso 0 dist 9.86662 8.69531 7.41373 9.1998 12.8086 5.83782 6.74887 11.2292 7.43401 6.44575 numMergedOcc 0
31 mol 134 unq 2 iso 0 dist 9.71307 9.1998 15.0225 8.69531 10.8635 5.83782 6.74887 10.9613 6.44575 7.43401 numMergedOcc 0
32 mol 134 unq 3 iso 0 dist 9.71307 8.69531 10.8635 9.1998 15.0225 5.83782 6.74887 10.9613 7.43401 6.44575 numMergedOcc 0
33 mol 143 unq 0 iso 0 dist 5.99315 7.36975 13.1926 5.40637 7.39837 10.1474 6.01455 9.27292 7.05845 10.55 numMergedOcc 0
34 mol 143 unq 1 iso 0 dist 5.99315 7.36975 13.1926 5.40637 7.39837 10.1474 5.44503 9.93541 8.18023 7.46803 numMergedOcc 0
35 mol 143 unq 2 iso 0 dist 5.99315 5.40637 7.39837 7.36975 13.1926 10.1474 5.44503 9.93541 7.46803 8.18023 numMergedOcc 0
36 mol 167 unq 0 iso 0 dist 9.87651 7.20495 7.87971 9.2289 12.0033 9.25262 6.36909 15.1367 9.1326 10.5288 numMergedOcc 0
37 mol 167 unq 1 iso 0 dist 9.87651 7.20495 7.87971 7.02548 11.6011 6.81449 6.36909 15.1367 9.1326 7.30954 numMergedOcc 0
38 mol 167 unq 2 iso 0 dist 9.87651 7.02548 11.6011 7.20495 7.87971 6.81449 6.36909 15.1367 7.30954 9.1326 numMergedOcc 0
39 mol 167 unq 3 iso 0 dist 9.87651 7.02548 11.6011 9.2289 12.0033 3.55199 6.36909 15.1367 7.30954 10.5288 numMergedOcc 0
40 mol 181 unq 0 iso 0 dist 7.81386 6.64173 6.8757 9.01624 5.71898 11.196 6.7991 4.93785 9.09234 6.76746 numMergedOcc 0
41 mol 181 unq 1 iso 0 dist 7.81386 6.64173 6.8757 9.55105 5.83796 10.1041 6.7991 4.93785 9.09234 8.92098 numMergedOcc 0
42 mol 181 unq 2 iso 0 dist 7.81386 9.01624 5.71898 6.64173 6.8757 11.196 6.7991 4.93785 6.76746 9.09234 numMergedOcc 0
43 mol 181 unq 3 iso 0 dist 7.81386 9.01624 5.71898 9.55105 5.83796 3.55187 6.7991 4.93785 6.76746 8.92098 numMergedOcc 0
44 mol 181 unq 4 iso 0 dist 7.81386 9.55105 5.83796 6.64173 6.8757 10.1041 6.7991 4.93785 8.92098 9.09234 numMergedOcc 0
45 mol 181 unq 5 iso 0 dist 7.81386 9.55105 5.83796 9.01624 5.71898 3.55187 6.7991 4.93785 8.92098 6.76746 numMergedOcc 0
46 mol 181 unq 6 iso 0 dist 7.63312 6.64173 10.6474 9.01624 5.93724 11.196 6.7991 10.1232 9.09234 6.76746 numMergedOcc 0
47 mol 181 unq 7 iso 0 dist 7.63312 6.64173 10.6474 9.55105 5.12833 10.1041 6.7991 10.1232 9.09234 8.92098 numMergedOcc 0
48 mol 181 unq 8 iso 0 dist 7.63312 9.01624 5.93724 6.64173 10.6474 11.196 6.7991 10.1232 6.76746 9.09234 numMergedOcc 0
49 mol 181 unq 9 iso 0 dist 7.63312 9.01624 5.93724 9.55105 5.12833 3.55187 6.7991 10.1232 6.76746 8.92098 numMergedOcc 0
50 mol 181 unq 10 iso 0 dist 7.63312 9.55105 5.12833 6.64173 10.6474 10.1041 6.7991 10.1232 8.92098 9.09234 numMergedOcc 0
51 mol 181 unq 11 iso 0 dist 7.63312 9.55105 5.12833 9.01624 5.93724 3.55187 6.7991 10.1232 8.92098 6.76746 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 7.46176 5.85442 10.067 6.95511 11.6988 3.51848 5.79468 7.48005 6.23661 9.43105 numMergedOcc 0
53 mol 259 unq 1 iso 0 dist 5.30224 8.03219 4.04513 6.9899 7.09907 8.0048 5.31048 8.37865 8.84648 6.23661 numMergedOcc 0
54 mol 259 unq 2 iso 0 dist 5.30224 6.9899 7.09907 8.03219 4.04513 8.0048 5.31048 8.37865 6.23661 8.84648 numMergedOcc 0
