0 mol 0 unq 0 iso 0 dist 8.34244 8.66548 8.73015 4.04089 6.64713 10.8612 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.97624 8.81608 5.5683 17.4118 8.60435 10.4105 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.497 9.06516 4.76998 14.3325 9.5053 6.38243 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 5.497 6.79475 5.39199 14.3325 9.5053 13.9894 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 7.60283 6.78936 13.4461 14.2471 7.45532 18.6132 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 5.55096 5.81001 4.06745 4.52443 8.80014 7.72462 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 7.6481 8.13051 5.45005 5.36808 6.62229 6.87028 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 7.03226 9.4866 10.1364 5.77727 9.75201 15.0426 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 6.0129 4.44979 3.92737 13.6622 8.43352 12.2279 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 6.0129 6.61111 3.94967 13.6622 8.43352 8.75597 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 5.79343 5.51885 4.08391 4.69847 9.17466 7.59156 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 7.26955 6.55202 10.3622 9.0892 9.9151 12.3083 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 7.26955 9.08536 14.9264 9.0892 9.9151 16.8494 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 7.36017 8.7789 3.9234 5.83002 5.94233 9.48975 numMergedOcc 0
14 mol 126 unq 1 iso 0 dist 7.36017 9.93613 5.50104 5.83002 5.94233 8.66815 numMergedOcc 0
15 mol 126 unq 2 iso 0 dist 5.14819 8.7789 6.1079 5.83002 8.56219 9.48975 numMergedOcc 0
16 mol 126 unq 3 iso 0 dist 5.14819 9.93613 7.02562 5.83002 8.56219 8.66815 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 6.87262 6.84165 5.46083 9.24851 7.82544 10.5314 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 6.87262 6.84165 5.46083 6.19569 6.18808 10.2106 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 8.55616 6.44575 11.5269 8.05714 9.30061 6.99345 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 8.55616 7.43401 6.93712 8.05714 9.30061 5.11043 numMergedOcc 0
21 mol 143 unq 0 iso 0 dist 9.30424 8.18023 13.1214 7.12863 6.95372 13.5717 numMergedOcc 0
22 mol 143 unq 1 iso 0 dist 9.30424 7.46803 4.06908 7.12863 6.95372 8.68663 numMergedOcc 0
23 mol 173 unq 0 iso 0 dist 6.64779 8.62366 11.3761 10.2821 8.03528 15.5457 numMergedOcc 0
24 mol 173 unq 1 iso 0 dist 6.64779 9.44973 9.90783 10.2821 8.03528 16.6992 numMergedOcc 0
25 mol 173 unq 2 iso 0 dist 6.64779 6.52508 4.60149 10.2821 8.03528 10.3478 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 8.97471 7.25339 3.87082 6.20673 7.02575 6.07389 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 8.52969 7.10155 7.41775 7.69247 5.68348 6.72182 numMergedOcc 0
28 mol 194 unq 1 iso 0 dist 8.52969 6.11135 11.4789 7.69247 5.68348 9.996 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 9.25517 6.86569 5.96499 6.56378 6.00582 8.52295 numMergedOcc 0
30 mol 237 unq 0 iso 0 dist 5.98039 7.12731 4.08768 9.38038 6.07878 9.88636 numMergedOcc 0
31 mol 237 unq 1 iso 0 dist 9.48932 7.12731 5.64112 9.38038 7.80422 9.88636 numMergedOcc 0
32 mol 243 unq 0 iso 0 dist 7.12785 9.33476 10.1372 8.16841 7.44706 13.6245 numMergedOcc 0
