0 mol 0 unq 0 iso 0 dist 8.84413 5.79741 7.74146 10.8257 7.96742 12.8105 16.3722 11.962 17.8699 5.55156 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.96742 7.19397 12.7706 10.8257 8.84413 15.4808 15.3975 12.5665 21.9485 8.74302 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 8.24206 9.98828 6.82018 7.19397 13.6664 9.5614 6.83587 13.3337 5.55156 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19397 7.96742 12.7706 6.82018 6.19218 12.962 5.55156 6.83587 11.962 9.5614 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 7.55357 5.86972 9.56267 9.83024 5.86243 13.4837 11.7939 5.39129 14.4367 7.57586 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 8.14932 6.17846 8.91253 6.90646 9.3473 10.5812 8.66921 9.82646 5.33496 9.10915 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 8.14932 6.17846 8.91253 6.90646 9.3473 10.5812 12.192 9.96083 12.9503 7.02352 numMergedOcc 0
7 mol 64 unq 2 iso 0 dist 6.17846 8.14932 8.91253 6.36389 6.08228 11.9527 8.66921 5.33496 9.82646 5.54343 numMergedOcc 0
8 mol 64 unq 3 iso 0 dist 6.17846 8.14932 8.91253 13.347 9.86958 18.1525 16.3435 10.8691 18.8642 9.99634 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 8.8095 9.32972 5.72775 9.29911 7.19203 12.3791 13.5752 9.51008 14.4889 7.14865 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 6.54338 9.39135 4.80422 5.84182 7.9663 10.0434 12.173 9.97628 13.2043 9.05626 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 7.47653 8.50054 5.90718 13.2888 7.9663 13.1193 16.7118 9.97628 11.3437 9.05626 numMergedOcc 0
12 mol 130 unq 2 iso 0 dist 7.47653 8.97124 4.80422 13.2888 7.9663 10.0434 16.7118 9.97628 13.2043 9.05626 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 7.96689 4.83134 8.94234 5.13345 9.6582 5.17734 9.14401 12.6081 5.26273 5.97805 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 4.83134 7.96689 8.94234 5.13345 5.17734 9.6582 9.14401 5.26273 12.6081 5.97805 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 6.24111 8.60412 9.07869 4.80965 9.00343 7.05535 8.07523 5.82028 4.62641 7.56882 numMergedOcc 0
16 mol 210 unq 1 iso 0 dist 9.00343 7.05535 9.07869 4.80965 6.24111 8.60412 7.56882 5.82028 4.62641 8.07523 numMergedOcc 0
17 mol 210 unq 2 iso 0 dist 8.60412 6.24111 9.07869 4.80965 7.05535 9.00343 8.07523 4.62641 5.82028 7.56882 numMergedOcc 0
18 mol 210 unq 3 iso 0 dist 7.05535 9.00343 9.07869 4.80965 8.60412 6.24111 7.56882 4.62641 5.82028 8.07523 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 5.97988 9.37276 8.07582 11.1019 9.08719 16.983 11.2702 7.85135 13.6761 7.04127 numMergedOcc 0
20 mol 230 unq 0 iso 0 dist 7.43793 8.4739 5.27013 5.96129 6.88683 11.0296 9.12305 6.87235 9.94041 8.33847 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 9.07452 7.21004 10.3541 10.1431 6.44266 8.75703 15.0027 9.61244 10.7877 9.79674 numMergedOcc 0
22 mol 274 unq 1 iso 0 dist 9.07452 7.21004 10.3541 10.1431 6.44266 8.75703 6.21831 6.57235 4.97216 8.3291 numMergedOcc 0
23 mol 274 unq 2 iso 0 dist 7.21004 9.07452 10.3541 10.1431 8.75703 6.44266 15.0027 10.7877 9.61244 9.79674 numMergedOcc 0
24 mol 274 unq 3 iso 0 dist 7.21004 9.07452 10.3541 10.1431 8.75703 6.44266 6.21831 4.97216 6.57235 8.3291 numMergedOcc 0
25 mol 274 unq 4 iso 0 dist 6.44266 8.75703 10.3541 10.1431 9.07452 7.21004 8.3291 6.57235 4.97216 6.21831 numMergedOcc 0
26 mol 274 unq 5 iso 0 dist 8.75703 6.44266 10.3541 10.1431 7.21004 9.07452 8.3291 4.97216 6.57235 6.21831 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 5.78017 8.78203 10.71 6.22487 6.12742 13.8375 6.47376 5.34376 5.86731 9.6147 numMergedOcc 0
28 mol 279 unq 1 iso 0 dist 6.12742 7.319 10.8005 6.22487 5.78017 12.6224 9.6147 5.34376 13.2117 6.47376 numMergedOcc 0
29 mol 279 unq 2 iso 0 dist 6.12742 9.45886 5.48262 6.22487 5.78017 10.7201 9.6147 5.34376 10.0132 6.47376 numMergedOcc 0
30 mol 285 unq 0 iso 0 dist 9.3482 8.70702 14.0317 7.91838 8.08495 12.5449 13.5103 8.39941 19.4269 7.66291 numMergedOcc 0
31 mol 285 unq 1 iso 0 dist 9.3482 9.43706 16.6298 7.91838 8.08495 17.0615 13.5103 8.39941 21.2488 7.66291 numMergedOcc 0
