0 mol 73 unq 0 iso 0 dist 6.04163 6.34076 5.93252 8.93939 4.60412 9.41049 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 8.88953 3.92763 5.93252 12.9794 4.60412 9.41049 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 9.17862 15.821 7.27724 18.9084 12.0894 9.64673 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 8.27456 9.7565 7.27724 9.11115 12.0894 9.64673 numMergedOcc 0
4 mol 95 unq 2 iso 0 dist 8.13273 14.1434 8.03644 21.2506 16.4832 9.64673 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.22628 10.0419 9.33865 14.5366 10.9791 7.9258 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.00798 5.57978 8.54584 13.2264 15.4586 8.00624 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.94909 8.76089 7.11802 17.2697 11.0256 9.1146 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 5.41229 4.51874 6.69288 14.1123 14.4816 9.63185 numMergedOcc 0
9 mol 178 unq 1 iso 0 dist 8.57378 4.51874 6.43573 14.1123 10.2893 9.63185 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 17.207 11.993 8.52924 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 7.86668 5.06314 6.18308 5.89811 5.4508 6.13878 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 8.52933 10.568 9.06952 14.9118 10.6678 8.83023 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 7.17032 5.44278 6.56247 5.68265 4.93623 5.46736 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 5.99137 13.3575 7.68742 14.5792 9.63949 6.61371 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 5.99137 5.03598 6.27581 7.61854 7.45579 5.90804 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 5.31858 6.60345 6.42289 7.87577 5.90131 9.04358 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 9.45818 13.2478 8.45658 15.5003 6.75336 7.00833 numMergedOcc 0
18 mol 261 unq 1 iso 0 dist 6.85589 5.85483 7.73141 5.74302 5.09097 9.77784 numMergedOcc 0
19 mol 261 unq 2 iso 0 dist 6.85589 4.31412 8.43057 5.74302 5.09097 5.00128 numMergedOcc 0
20 mol 261 unq 3 iso 0 dist 6.85589 4.31412 8.43057 10.4193 11.9784 6.58604 numMergedOcc 0
21 mol 261 unq 4 iso 0 dist 6.85589 4.31412 8.43057 11.2165 11.6843 7.30472 numMergedOcc 0
22 mol 261 unq 5 iso 0 dist 6.68878 4.31412 6.05727 5.74302 4.86901 5.00128 numMergedOcc 0
23 mol 261 unq 6 iso 0 dist 6.68878 4.31412 6.05727 10.4193 9.47323 6.58604 numMergedOcc 0
24 mol 261 unq 7 iso 0 dist 6.68878 4.31412 6.05727 11.2165 7.78464 7.30472 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 7.34596 4.36798 8.76532 11.5041 11.2986 7.71088 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 7.12228 4.36798 6.33524 11.5041 7.46064 7.71088 numMergedOcc 0
