0 mol 11 unq 0 iso 0 dist 9.76607 7.77766 5.96136 9.88198 8.27779 4.46511 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.34802 5.87895 7.53308 7.06532 8.14521 6.38336 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.34802 9.57974 5.42522 7.06532 8.14521 6.51 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.73832 9.89021 10.539 8.3768 13.8226 10.9261 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.73832 9.89021 10.539 8.13535 14.2469 14.3261 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 7.85973 9.89021 7.03229 8.3768 7.39314 10.9261 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 7.85973 9.89021 7.03229 8.13535 9.95198 14.3261 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 8.30943 7.76275 6.77337 7.01545 6.60008 7.0785 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.46036 6.30103 10.9352 7.31426 5.47738 8.51055 numMergedOcc 0
9 mol 125 unq 0 iso 0 dist 9.07195 9.63302 8.96999 7.00113 10.5435 7.43922 numMergedOcc 0
10 mol 125 unq 1 iso 0 dist 9.07195 9.63302 8.96999 9.85979 14.8266 11.0769 numMergedOcc 0
11 mol 125 unq 2 iso 0 dist 9.67137 9.63302 5.14495 7.00113 6.46489 7.43922 numMergedOcc 0
12 mol 125 unq 3 iso 0 dist 9.67137 9.63302 5.14495 9.85979 8.27647 11.0769 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 9.69202 8.66709 4.97552 9.83653 3.9258 6.3363 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 9.26421 8.66709 7.23278 9.83653 5.60424 6.3363 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 6.03275 8.84671 8.40757 9.31172 9.16343 13.2996 numMergedOcc 0
16 mol 174 unq 0 iso 0 dist 7.22982 8.4931 8.06693 5.07761 9.95547 7.29873 numMergedOcc 0
17 mol 188 unq 0 iso 0 dist 8.88948 7.63268 8.2743 9.26919 4.22494 6.38128 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.87588 9.85951 9.47501 8.32948 12.2382 11.5838 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.50474 9.27989 14.3464 6.91534 4.9395 11.169 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 9.50474 9.27989 14.3464 8.67704 8.72829 14.8007 numMergedOcc 0
21 mol 256 unq 0 iso 0 dist 9.75158 7.54586 8.10067 9.65136 5.9669 10.134 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 6.96911 7.46199 6.11415 8.51736 11.51 9.5662 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.06324 5.17586 5.31331 9.24164 9.87866 11.5885 numMergedOcc 0
24 mol 284 unq 0 iso 0 dist 6.81709 8.08993 14.1961 4.87349 4.47263 10.6664 numMergedOcc 0
25 mol 284 unq 1 iso 0 dist 6.81709 7.34344 5.87119 4.87349 4.47263 4.50325 numMergedOcc 0
