0 mol 1 unq 0 iso 0 dist 6.04659 8.93702 6.03793 5.99543 8.27735 8.56884 numMergedOcc 0
1 mol 100 unq 0 iso 0 dist 8.9164 9.9443 5.95362 5.82808 11.5655 9.39469 numMergedOcc 0
2 mol 100 unq 1 iso 0 dist 8.9164 9.9443 5.95362 10.2548 9.97555 4.76815 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 9.23558 8.94447 14.5117 12.7099 20.3655 6.81812 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.05293 9.6785 10.0448 9.04668 14.5927 6.96442 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.96762 5.43229 5.39389 5.98221 5.11612 7.76729 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 7.98255 9.59094 10.1824 11.0811 15.8905 7.92688 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 9.33818 9.4422 13.951 12.4033 19.0933 8.62646 numMergedOcc 0
8 mol 189 unq 0 iso 0 dist 8.91697 5.79707 4.81181 5.56399 11.078 6.50241 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 9.60392 8.87757 4.70359 11.4265 5.5581 9.59333 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 5.13145 8.87757 4.21758 11.4265 9.66975 9.59333 numMergedOcc 0
11 mol 218 unq 0 iso 0 dist 6.25383 7.89694 6.81684 7.82717 11.0189 9.50586 numMergedOcc 0
12 mol 218 unq 1 iso 0 dist 6.25383 5.66171 4.40481 12.0404 10.7262 7.17547 numMergedOcc 0
13 mol 218 unq 2 iso 0 dist 6.25383 5.66171 4.40481 7.82717 11.0189 7.13323 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 9.31001 7.54327 13.8184 5.28657 9.09043 6.16063 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 8.87308 6.89216 12.2455 11.0676 17.724 6.91569 numMergedOcc 0
16 mol 253 unq 0 iso 0 dist 9.78986 7.83041 7.03342 12.3321 14.0833 7.19465 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 5.87353 5.50677 8.86815 14.447 16.2245 9.0012 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 5.87353 8.75957 10.6068 14.447 16.2245 9.5784 numMergedOcc 0
19 mol 264 unq 2 iso 0 dist 7.87214 5.50677 6.48134 14.447 10.8933 9.0012 numMergedOcc 0
20 mol 264 unq 3 iso 0 dist 7.87214 8.75957 6.34771 14.447 10.8933 9.5784 numMergedOcc 0
