0 mol 54 unq 0 iso 0 dist 8.34361 4.38047 5.01159 4.94741 6.10175 5.7405 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 9.39738 6.66861 5.99401 10.9658 14.3132 9.95327 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 9.39738 6.66861 5.99401 8.71074 11.1925 7.50825 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 9.9421 6.72084 5.99401 6.24438 14.3132 9.95327 numMergedOcc 0
4 mol 55 unq 3 iso 0 dist 9.9421 6.72084 5.99401 12.0589 11.1925 7.50825 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 7.28161 6.37888 4.76916 4.90255 11.3414 8.66742 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 4.98783 7.11438 4.76916 9.84923 11.3414 8.66742 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.55124 7.4518 11.6667 12.7865 15.2672 8.0955 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 9.28645 5.42828 5.54999 8.86411 12.1635 9.69961 numMergedOcc 0
9 mol 116 unq 0 iso 0 dist 8.51507 7.6005 7.11876 5.17486 10.9832 6.63731 numMergedOcc 0
10 mol 116 unq 1 iso 0 dist 8.22285 8.7583 7.11876 6.28627 10.9832 6.63731 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.53875 7.6793 12.6641 5.05068 13.1361 6.37143 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 9.51041 7.42278 7.35345 8.62822 14.3793 8.57607 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 8.21479 9.41148 13.3182 8.30148 13.2151 9.92671 numMergedOcc 0
14 mol 232 unq 1 iso 0 dist 8.21479 7.83422 8.15893 8.47021 4.46314 6.23146 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.11437 9.69704 5.01342 17.557 13.8567 9.6479 numMergedOcc 0
16 mol 292 unq 0 iso 0 dist 9.86767 6.60049 6.28133 9.93138 15.3552 9.46421 numMergedOcc 0
