0 mol 9 unq 0 iso 0 dist 9.3793 7.25179 5.53103 8.90391 14.7497 9.62394 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.60396 8.47617 12.7554 12.8271 17.527 8.95682 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.92027 6.56664 4.47138 6.71938 8.2746 7.56205 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 7.92027 9.58156 10.9596 6.71938 8.2746 4.74544 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 6.08756 7.99003 4.47138 5.31715 8.2746 7.56205 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 7.62621 8.00525 10.2967 5.75219 5.51406 9.30539 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 7.62621 8.00525 10.2967 12.8512 10.8615 9.01176 numMergedOcc 0
7 mol 108 unq 0 iso 0 dist 8.69068 5.45787 4.93762 5.35819 9.51844 9.01852 numMergedOcc 0
8 mol 108 unq 1 iso 0 dist 8.69068 5.45787 4.93762 6.01187 13.3384 9.75958 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.28452 8.29529 14.0364 5.89952 9.09263 8.8822 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 8.28452 8.29529 14.0364 5.58964 5.37302 9.66219 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.94464 9.50454 9.32503 6.15536 9.07527 5.9176 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.94464 9.50454 9.32503 14.7795 14.9148 6.41453 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 8.94464 7.15963 13.2985 10.5886 10.547 8.90963 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 8.63713 9.50454 8.88398 6.15536 10.9985 5.9176 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 8.63713 9.50454 8.88398 14.7795 14.415 6.41453 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 8.63713 7.15963 4.98009 10.5886 8.63119 8.90963 numMergedOcc 0
17 mol 181 unq 6 iso 0 dist 5.08796 6.43406 4.3158 11.4522 12.7332 9.39829 numMergedOcc 0
18 mol 181 unq 7 iso 0 dist 5.93515 6.43406 4.3226 11.4522 9.46838 9.39829 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 8.61953 9.14737 10.5326 14.372 16.3411 7.50013 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 8.61953 9.14737 10.5326 14.6749 15.8131 5.81233 numMergedOcc 0
21 mol 197 unq 2 iso 0 dist 8.61953 9.14737 10.5326 5.9589 10.5245 6.92924 numMergedOcc 0
22 mol 197 unq 3 iso 0 dist 8.61953 9.14737 10.5326 9.27427 15.0846 7.14306 numMergedOcc 0
23 mol 197 unq 4 iso 0 dist 7.91999 9.14737 5.29309 14.372 11.2331 7.50013 numMergedOcc 0
24 mol 197 unq 5 iso 0 dist 7.91999 9.14737 5.29309 14.6749 10.433 5.81233 numMergedOcc 0
25 mol 197 unq 6 iso 0 dist 7.91999 9.14737 5.29309 5.9589 7.40027 6.92924 numMergedOcc 0
26 mol 197 unq 7 iso 0 dist 7.91999 9.14737 5.29309 9.27427 11.0908 7.14306 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 8.92585 6.51823 10.7712 12.1252 10.1235 8.67864 numMergedOcc 0
28 mol 265 unq 0 iso 0 dist 6.98451 7.83102 9.74462 4.40079 10.2019 6.71375 numMergedOcc 0
