0 mol 43 unq 0 iso 0 dist 9.16827 5.19462 5.07458 5.15224 12.5807 8.03914 9.85414 13.4821 8.8955 7.75667 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.31319 9.72136 13.1434 9.89704 17.5682 8.16183 8.99557 15.919 8.55766 8.55031 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 8.2513 9.72136 14.5035 9.89704 15.6381 8.16183 8.99557 17.0196 8.55766 8.55031 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 7.95122 8.55467 8.70781 6.73368 11.7089 5.80074 12.3042 10.1593 4.16694 9.73488 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 9.74268 8.55467 13.4238 6.73368 15.3547 5.80074 12.3042 14.9865 4.16694 9.73488 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.89394 8.3435 4.46885 5.73112 4.98104 8.67475 9.79055 7.17015 7.18067 6.78043 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 5.89394 8.3435 4.46885 5.73112 4.98104 8.67475 9.28919 4.52119 5.74315 5.74364 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 6.59361 8.27843 8.4494 6.82715 5.25492 9.24252 11.9206 6.39786 10.3414 6.70591 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 6.59361 8.27843 8.4494 6.82715 5.25492 9.24252 11.699 8.50777 10.3403 5.43052 numMergedOcc 0
9 mol 148 unq 0 iso 0 dist 8.62898 6.02506 9.29878 6.33907 14.0476 8.3656 14.4197 19.4265 13.5761 9.22427 numMergedOcc 0
10 mol 148 unq 1 iso 0 dist 9.7168 9.8506 15.239 7.50382 16.4612 8.3656 8.6499 12.8573 13.5761 9.22427 numMergedOcc 0
11 mol 148 unq 2 iso 0 dist 7.38138 9.8506 8.68046 7.50382 10.69 8.3656 8.6499 8.61198 13.5761 9.22427 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 8.6102 6.07854 9.35505 6.43607 14.1199 8.44633 14.599 19.5967 13.6344 9.32504 numMergedOcc 0
13 mol 150 unq 1 iso 0 dist 9.61132 9.91991 15.2388 7.48524 16.3796 8.44633 8.75339 12.8265 13.6344 9.32504 numMergedOcc 0
14 mol 150 unq 2 iso 0 dist 7.34423 9.91991 8.55576 7.48524 10.6513 8.44633 8.75339 8.68422 13.6344 9.32504 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 8.28941 5.01648 4.64118 5.51329 9.91098 5.27487 6.00351 6.20364 3.59923 5.89788 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 8.74123 6.112 6.28653 10.7067 14.3061 8.38813 8.6641 9.39073 3.5359 6.2441 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.29203 9.97859 16.7443 16.9796 21.1599 8.28643 12.3224 17.773 5.17342 9.46728 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 7.62771 9.97859 13.1408 16.9796 16.8553 8.28643 12.3224 15.3161 5.17342 9.46728 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 7.80166 9.97859 10.4706 16.9796 16.0821 8.28643 12.3224 9.18011 5.17342 9.46728 numMergedOcc 0
