0 mol 7 unq 0 iso 0 dist 5.77374 9.8603 5.70161 9.33944 8.0166 6.22805 14.6665 12.2471 7.10621 6.96396 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 9.8603 4.57188 9.33944 9.32945 6.22805 14.6665 10.2729 7.10621 6.96396 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 9.42142 8.13983 7.00835 5.06934 7.66311 8.91266 5.63648 8.39221 6.38364 4.15151 numMergedOcc 0
3 mol 51 unq 0 iso 0 dist 6.50216 7.12423 5.27155 10.8401 7.95419 9.06397 13.6102 13.9156 9.0709 12.8917 numMergedOcc 0
4 mol 51 unq 1 iso 0 dist 9.83073 7.12423 14.6972 10.8401 17.5277 9.06397 13.6102 22.9247 9.0709 12.8917 numMergedOcc 0
5 mol 71 unq 0 iso 0 dist 7.51457 8.85372 6.48988 13.9588 13.1226 8.21553 9.64576 11.9058 7.38797 5.87956 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 7.53682 5.39171 6.30194 4.69583 6.89722 6.19304 10.5627 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.10386 6.18305 5.44275 7.53682 9.27355 6.30194 4.69583 7.26679 6.19304 10.5627 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 6.53806 6.7973 6.68061 6.12669 11.1871 7.28355 5.01118 9.70079 6.23493 4.8645 numMergedOcc 0
9 mol 155 unq 1 iso 0 dist 8.47335 6.7973 5.27475 6.12669 10.1478 7.28355 5.01118 10.5286 6.23493 4.8645 numMergedOcc 0
10 mol 236 unq 0 iso 0 dist 8.01164 9.05929 10.6351 6.0905 12.3547 6.73134 4.32403 10.4926 8.04248 5.52669 numMergedOcc 0
11 mol 236 unq 1 iso 0 dist 8.01164 9.05929 10.6351 6.0905 12.3547 6.73134 4.38595 8.96717 8.35971 5.27568 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 9.46728 8.59074 16.5687 12.1988 20.7961 7.98022 9.18011 16.0821 5.72887 6.3873 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 9.91921 6.2365 6.62361 6.12122 6.74214 7.98022 4.7157 9.31417 5.72887 6.3873 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 8.20243 6.2365 5.96552 6.12122 5.33462 7.98022 4.7157 5.56719 5.72887 6.3873 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 8.15897 9.18476 4.86437 6.70277 9.174 6.40592 9.87799 9.72526 7.4631 7.93809 numMergedOcc 0
16 mol 256 unq 0 iso 0 dist 9.37687 7.67598 9.07441 6.78978 14.8948 8.43264 8.99993 14.2736 8.29103 6.19628 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 5.98006 8.06771 5.71237 5.73217 6.76656 6.96379 6.64729 6.77279 8.13497 10.908 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 5.98006 8.06771 5.71237 5.73217 6.76656 6.96379 9.79538 9.58006 7.88519 12.7595 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 9.71653 7.74162 6.03718 6.05412 8.57035 5.17586 9.5773 14.3672 9.70696 5.9229 numMergedOcc 0
