0 mol 24 unq 0 iso 0 dist 9.75144 7.49157 6.72423 6.00575 8.62284 9.41655 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.75144 7.73794 4.0664 6.00575 8.62284 6.803 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.63333 9.23438 4.43437 6.89191 7.93481 11.3972 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 8.89374 7.17488 4.43437 11.0355 7.93481 11.3972 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 6.46761 6.79356 4.43437 11.3547 7.93481 11.3972 numMergedOcc 0
5 mol 107 unq 0 iso 0 dist 8.40312 9.45682 6.48911 8.71052 8.13921 10.0548 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.39889 4.80684 3.71283 4.91594 9.05798 8.34342 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 7.39889 4.80684 3.71283 9.3046 5.85818 7.62197 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 6.79146 9.81269 9.6361 7.55374 6.42785 14.3777 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 6.79146 9.81269 9.6361 9.44878 6.82089 12.7928 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 8.33261 6.73617 6.60281 12.6979 7.01133 13.1125 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 8.33261 9.03544 9.65163 12.6979 7.01133 15.6379 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 7.98142 8.29467 9.55459 9.92777 5.49808 13.9379 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 7.37327 8.29467 7.66761 9.92777 7.96291 13.9379 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 9.52936 9.84566 4.11581 8.41716 6.21206 9.12454 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 9.52936 8.22001 12.4034 8.41716 6.21206 14.836 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 6.90541 7.86092 4.61059 5.48276 7.48284 6.18257 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 7.90031 9.76973 8.56728 6.74772 8.15936 5.20846 numMergedOcc 0
18 mol 198 unq 1 iso 0 dist 7.21533 9.76973 6.76174 6.74772 8.16598 5.20846 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 7.18041 6.1896 4.24855 5.7776 6.86795 8.98941 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 7.18041 6.1896 4.24855 5.282 6.23898 5.4621 numMergedOcc 0
21 mol 218 unq 2 iso 0 dist 7.18041 6.09255 5.31276 5.7776 6.86795 6.45381 numMergedOcc 0
22 mol 218 unq 3 iso 0 dist 7.18041 6.09255 5.31276 5.282 6.23898 8.91819 numMergedOcc 0
23 mol 218 unq 4 iso 0 dist 7.17547 6.1896 10.7049 10.3246 9.67381 15.2902 numMergedOcc 0
24 mol 218 unq 5 iso 0 dist 7.17547 6.1896 10.7049 5.7776 6.61099 8.98941 numMergedOcc 0
25 mol 218 unq 6 iso 0 dist 7.17547 6.09255 4.36581 10.3246 9.67381 12.0395 numMergedOcc 0
26 mol 218 unq 7 iso 0 dist 7.17547 6.09255 4.36581 5.7776 6.61099 6.45381 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 9.58736 8.08965 14.2299 15.0089 9.31673 21.8873 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 8.37865 9.18798 10.5148 7.31951 6.39918 13.8208 numMergedOcc 0
29 mol 259 unq 1 iso 0 dist 8.37865 8.25897 11.0001 7.31951 6.39918 14.1339 numMergedOcc 0
