0 mol 0 unq 0 iso 0 dist 9.42137 7.65884 9.23213 8.60656 7.40865 9.30151 7.31837 5.24778 8.34244 10.4616 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.7435 11.1513 9.53002 4.08268 4.30695 11.9464 11.4417 10.9183 8.73067 13.8519 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 5.7435 11.1513 9.53002 4.24301 6.35398 7.5901 11.4417 10.9183 8.73067 7.98326 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 5.97635 8.98505 5.02241 11.5332 7.21717 11.0681 4.38047 4.29856 6.30987 10.7227 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 4.88613 9.80755 8.89374 4.37642 7.68678 12.0055 5.84625 5.49591 9.11258 10.2007 numMergedOcc 0
5 mol 181 unq 0 iso 0 dist 9.84952 11.14 7.98142 6.78739 5.94469 8.93991 13.401 5.63555 5.97685 10.3104 numMergedOcc 0
6 mol 181 unq 1 iso 0 dist 9.84952 10.9006 7.37327 6.78739 5.94469 5.35588 13.401 5.63555 8.9289 10.3104 numMergedOcc 0
7 mol 232 unq 0 iso 0 dist 7.70279 6.17401 7.07392 6.36084 8.50102 10.9886 9.41148 6.2188 7.10413 9.78181 numMergedOcc 0
8 mol 235 unq 0 iso 0 dist 9.11256 14.9183 9.58736 3.93066 9.55668 13.128 20.5976 15.6327 7.31773 17.8712 numMergedOcc 0
9 mol 235 unq 1 iso 0 dist 7.08539 4.28284 9.58736 13.0408 9.55668 13.128 11.2839 15.6327 7.31773 17.8712 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 9.32451 4.81145 6.05141 16.2294 8.94014 11.5793 11.9862 10.7081 8.09718 10.6756 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 9.32451 4.81145 6.05141 16.2294 8.94014 11.5793 11.4318 5.50308 6.73446 5.92374 numMergedOcc 0
12 mol 264 unq 0 iso 0 dist 8.43858 12.5468 9.0012 4.29482 7.16853 9.76317 13.7665 7.52936 5.91213 10.3854 numMergedOcc 0
13 mol 264 unq 1 iso 0 dist 8.43858 15.8008 9.5784 4.29482 7.16853 13.9064 13.7665 7.52936 7.34094 10.3854 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 6.55855 5.95459 9.19234 6.70266 9.45514 12.625 6.83113 5.64601 9.20749 10.083 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 6.55855 5.95459 9.19234 5.15747 6.39866 4.60275 6.83113 5.64601 9.20749 9.16942 numMergedOcc 0
