0 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 11.0672 12.5689 9.7522 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.66602 9.72289 5.3315 18.4863 12.5689 9.7522 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.60396 8.47617 12.7554 12.345 13.2094 8.38387 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 7.92027 9.58156 10.9596 11.1016 15.5808 8.1599 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.7385 7.63534 6.35022 10.4745 12.9379 8.58841 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 8.61468 9.45835 7.17843 11.1106 9.84346 9.23023 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 6.27186 9.45835 4.4651 11.1106 9.46472 9.23023 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 8.36172 7.2461 6.16247 7.8832 11.192 7.09405 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.28452 8.29529 14.0364 6.68968 9.64281 8.89481 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 5.59311 8.94909 14.4095 6.45157 11.6694 5.86531 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.22456 8.94909 17.145 6.45157 15.667 5.86531 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 5.7232 8.94909 5.37072 6.45157 7.12336 5.86531 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 8.30966 9.0847 12.2051 11.6766 12.136 8.07256 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 5.76319 7.84536 4.57882 7.42251 7.556 6.25429 numMergedOcc 0
14 mol 196 unq 1 iso 0 dist 5.30132 7.07723 4.57882 10.0417 7.556 6.25429 numMergedOcc 0
15 mol 196 unq 2 iso 0 dist 8.36119 8.69629 6.70722 7.06113 7.556 6.87731 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 7.79013 8.18588 7.20238 5.06075 9.40808 8.40773 numMergedOcc 0
17 mol 241 unq 1 iso 0 dist 7.79013 8.18588 7.20238 13.1806 15.6286 9.18476 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 8.93002 5.29682 6.64729 6.00285 9.05363 5.90645 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 6.98451 7.83102 9.74462 9.76011 11.4903 7.04833 numMergedOcc 0
20 mol 267 unq 0 iso 0 dist 9.60447 6.19138 10.2663 4.13132 13.1852 9.62043 numMergedOcc 0
