0 mol 0 unq 0 iso 0 dist 9.72725 14.2251 8.66548 9.64573 6.94943 5.96303 13.3675 8.73015 8.34244 10.8762 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.12845 14.1424 9.06516 5.30734 6.38243 14.3325 13.6548 5.29055 6.15893 11.5353 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.12845 14.1424 9.06516 5.30734 6.38243 14.3325 10.3756 4.76998 5.497 9.5053 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 6.24711 5.32981 7.08559 14.0576 9.58596 16.1649 10.7798 5.70782 8.90835 10.5969 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 5.94756 7.39653 5.81001 6.18811 7.72462 4.52443 9.49841 4.06745 5.55096 8.80014 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 9.97769 10.3598 8.13051 7.40296 6.87028 5.36808 12.9819 5.45005 7.6481 6.62229 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 9.32706 6.00578 8.13051 5.89202 6.87028 5.36808 11.3538 5.45005 7.6481 6.62229 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 9.08221 11.6697 8.13051 6.37648 6.87028 5.36808 9.86039 5.45005 7.6481 6.62229 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.10496 8.70415 6.61111 7.32662 8.75597 13.6622 6.7117 3.94967 6.0129 8.43352 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 5.10496 8.70415 6.61111 12.3881 9.18457 6.34014 6.7117 3.94967 6.0129 10.5879 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 9.64383 12.0058 4.44979 8.76845 6.83746 5.92812 12.5931 3.92737 6.0129 10.3996 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 9.64383 12.0058 4.44979 11.7715 9.14707 6.34014 12.5931 3.92737 6.0129 10.5879 numMergedOcc 0
12 mol 98 unq 4 iso 0 dist 5.92242 9.74284 6.61111 13.4985 8.75597 13.6622 9.42961 3.94967 6.0129 8.43352 numMergedOcc 0
13 mol 98 unq 5 iso 0 dist 5.92242 9.74284 6.61111 7.89505 9.18457 6.34014 9.42961 3.94967 6.0129 10.5879 numMergedOcc 0
14 mol 98 unq 6 iso 0 dist 7.54889 10.0962 4.44979 13.9572 6.83746 5.92812 4.47349 3.92737 6.0129 10.3996 numMergedOcc 0
15 mol 98 unq 7 iso 0 dist 7.54889 10.0962 4.44979 13.1975 9.14707 6.34014 4.47349 3.92737 6.0129 10.5879 numMergedOcc 0
16 mol 98 unq 8 iso 0 dist 5.2571 10.0962 6.61111 6.934 8.75597 13.6622 4.47349 3.94967 6.0129 8.43352 numMergedOcc 0
17 mol 98 unq 9 iso 0 dist 5.2571 10.0962 6.61111 13.1975 9.18457 6.34014 4.47349 3.94967 6.0129 10.5879 numMergedOcc 0
18 mol 98 unq 10 iso 0 dist 7.78931 11.2452 4.44979 14.5341 6.83746 5.92812 5.65185 3.92737 6.0129 10.3996 numMergedOcc 0
19 mol 98 unq 11 iso 0 dist 7.78931 11.2452 4.44979 15.9953 9.14707 6.34014 5.65185 3.92737 6.0129 10.5879 numMergedOcc 0
20 mol 98 unq 12 iso 0 dist 8.7497 11.2452 6.61111 7.17433 8.75597 13.6622 5.65185 3.94967 6.0129 8.43352 numMergedOcc 0
21 mol 98 unq 13 iso 0 dist 8.7497 11.2452 6.61111 15.9953 9.18457 6.34014 5.65185 3.94967 6.0129 10.5879 numMergedOcc 0
22 mol 114 unq 0 iso 0 dist 5.7144 6.95201 5.51885 5.6074 7.59156 4.69847 9.39063 4.08391 5.79343 9.17466 numMergedOcc 0
23 mol 119 unq 0 iso 0 dist 8.95212 16.7975 9.08536 13.52 9.57341 8.96522 22.9076 14.9264 7.26955 16.0882 numMergedOcc 0
24 mol 119 unq 1 iso 0 dist 6.99446 7.36192 9.08536 4.99056 9.57341 8.96522 14.2293 14.9264 7.26955 16.0882 numMergedOcc 0
25 mol 119 unq 2 iso 0 dist 7.64052 10.6679 9.08536 3.78311 9.57341 8.96522 17.9198 14.9264 7.26955 16.0882 numMergedOcc 0
26 mol 134 unq 0 iso 0 dist 6.42772 5.31077 6.44575 11.7434 6.99345 8.05714 12.1214 11.5269 8.55616 9.30061 numMergedOcc 0
27 mol 134 unq 1 iso 0 dist 9.33094 5.3585 7.43401 9.4027 5.11043 8.05714 6.23142 6.93712 8.55616 9.30061 numMergedOcc 0
28 mol 134 unq 2 iso 0 dist 9.1998 6.74887 6.44575 5.12325 6.99345 8.05714 9.94764 11.5269 8.55616 9.30061 numMergedOcc 0
29 mol 134 unq 3 iso 0 dist 8.69531 6.74887 7.43401 5.12325 5.11043 8.05714 9.94764 6.93712 8.55616 9.30061 numMergedOcc 0
30 mol 134 unq 4 iso 0 dist 5.35237 8.96357 6.57379 6.02179 8.48313 13.6926 11.2661 6.32315 6.21403 14.687 numMergedOcc 0
31 mol 134 unq 5 iso 0 dist 8.70621 10.9715 6.44575 6.02179 6.99345 8.05714 15.049 11.5269 8.55616 9.30061 numMergedOcc 0
32 mol 134 unq 6 iso 0 dist 7.99477 5.9915 6.57379 10.9332 8.48313 13.6926 11.2937 6.32315 6.21403 14.687 numMergedOcc 0
33 mol 143 unq 0 iso 0 dist 5.40637 5.44503 7.46803 10.8441 8.68663 7.12863 9.14266 4.06908 9.30424 6.95372 numMergedOcc 0
34 mol 267 unq 0 iso 0 dist 8.8293 7.11419 5.08174 6.74922 7.60505 9.7551 13.8725 5.68457 9.01354 12.5839 numMergedOcc 0
35 mol 267 unq 1 iso 0 dist 7.34981 6.45566 5.08174 9.163 7.60505 9.7551 10.2761 5.68457 9.01354 12.5839 numMergedOcc 0
36 mol 279 unq 0 iso 0 dist 6.35028 7.69081 6.0283 6.15987 5.81528 4.66909 13.337 9.85432 9.24367 13.2249 numMergedOcc 0
37 mol 292 unq 0 iso 0 dist 9.46442 12.1551 5.84792 9.84292 9.2558 6.67435 14.0184 5.93687 5.7131 11.9814 numMergedOcc 0
38 mol 292 unq 1 iso 0 dist 9.9182 18.0293 8.73515 16.2289 9.84946 6.67435 19.2773 9.40023 5.7131 11.9814 numMergedOcc 0
39 mol 292 unq 2 iso 0 dist 7.30758 12.1551 8.73515 9.84292 9.84946 6.67435 14.0184 9.40023 5.7131 11.9814 numMergedOcc 0
40 mol 292 unq 3 iso 0 dist 9.10788 10.8709 8.73515 8.96137 9.84946 6.67435 14.6101 9.40023 5.7131 11.9814 numMergedOcc 0
