0 mol 0 unq 0 iso 0 dist 7.96742 7.19397 12.7706 10.8652 8.66612 11.894 7.1599 15.0192 7.19621 15.2902 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.96742 7.19397 12.7706 10.8257 8.84413 15.4808 7.1599 15.0192 7.19621 15.3542 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 8.24206 9.98828 6.82018 7.19397 13.6664 5.25456 7.19621 7.37981 7.1599 numMergedOcc 0
3 mol 2 unq 0 iso 0 dist 9.08872 9.74371 6.23988 11.6166 7.37296 11.9277 9.97525 9.58976 6.35342 11.2776 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 9.32945 9.90117 5.38328 17.0748 9.67498 13.5103 6.96396 10.2729 7.21217 19.4202 numMergedOcc 0
5 mol 38 unq 0 iso 0 dist 7.55357 5.86972 9.56267 9.83024 5.86243 13.4837 7.46414 12.6659 9.23576 16.0935 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.60363 5.39171 5.05066 16.6115 9.27331 14.0106 10.5627 10.1503 6.89722 17.0763 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.60363 9.27355 4.4628 16.6115 9.27331 10.0291 10.8067 9.72442 9.68526 10.163 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 8.60363 9.27355 4.4628 16.6115 9.27331 10.0291 10.5627 10.1503 7.26679 17.0763 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 8.60363 9.27355 4.4628 16.6115 9.27331 10.0291 17.4113 13.2514 9.30776 12.3629 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 4.83134 7.96689 8.94234 5.13345 5.17734 9.6582 11.9436 13.7358 9.48243 16.3678 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 5.17734 9.6582 8.94234 5.13345 4.83134 7.96689 16.3678 13.7358 9.48243 11.9436 numMergedOcc 0
12 mol 133 unq 2 iso 0 dist 5.12189 7.50126 11.0817 10.5053 7.50911 16.3433 15.9524 18.3258 8.84018 23.7467 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 8.82165 7.38622 4.87816 10.7204 5.69763 10.0612 5.55582 9.48439 7.32478 11.4562 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 8.60412 6.24111 9.07869 4.80965 7.05535 9.00343 13.3929 9.90494 9.67457 12.3088 numMergedOcc 0
15 mol 210 unq 1 iso 0 dist 7.05535 9.00343 9.07869 4.80965 8.60412 6.24111 12.3088 9.90494 9.67457 13.3929 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 6.6537 9.08719 11.6002 11.1434 7.47122 18.5793 4.55824 9.75313 6.08709 15.4433 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 9.08719 6.6537 11.6002 11.1019 5.97988 15.7687 4.55824 6.08709 9.75313 6.70321 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 9.07452 7.21004 10.3541 10.1431 6.44266 8.75703 6.11218 7.80446 9.91395 6.98398 numMergedOcc 0
19 mol 274 unq 1 iso 0 dist 7.21004 9.07452 10.3541 10.1431 8.75703 6.44266 6.11218 9.91395 7.80446 6.98398 numMergedOcc 0
20 mol 274 unq 2 iso 0 dist 7.21004 9.07452 10.3541 10.1431 8.75703 6.44266 11.3921 13.506 9.86142 6.99898 numMergedOcc 0
21 mol 274 unq 3 iso 0 dist 6.44266 8.75703 10.3541 10.1431 9.07452 7.21004 6.98398 7.80446 9.91395 6.11218 numMergedOcc 0
22 mol 274 unq 4 iso 0 dist 8.75703 6.44266 10.3541 10.1431 7.21004 9.07452 6.98398 9.91395 7.80446 6.11218 numMergedOcc 0
23 mol 274 unq 5 iso 0 dist 8.75703 6.44266 10.3541 10.1431 7.21004 9.07452 6.99898 13.506 9.86142 11.3921 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 8.63954 4.74716 6.55738 14.0446 7.97209 13.5011 5.93692 13.8061 8.71213 19.8465 numMergedOcc 0
