0 mol 73 unq 0 iso 0 dist 9.79061 4.78435 9.73086 5.00474 6.14542 5.11416 11.6724 5.70116 9.96396 9.24757 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 9.79061 4.78435 9.73086 5.00474 6.14542 5.11416 10.2786 17.4121 9.38498 13.8696 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 9.79061 4.78435 9.73086 5.00474 6.14542 5.11416 14.5091 14.844 9.75218 13.0145 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 9.79061 6.33833 7.4369 5.00474 6.14542 6.56633 11.6724 5.70116 6.19304 9.24757 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.88752 10.9364 8.77023 12.8098 8.83732 4.54648 17.1647 13.0405 6.29155 6.16242 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 8.88752 10.9364 8.77023 12.8098 8.83732 4.54648 14.4401 13.7612 6.80239 5.87634 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 8.88752 10.9364 8.77023 12.8098 8.83732 4.54648 11.7499 15.0115 8.00618 10.9061 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 8.99128 14.7612 8.97626 11.7393 9.16358 5.50031 17.1751 9.16779 7.46303 12.2416 numMergedOcc 0
8 mol 155 unq 1 iso 0 dist 8.99128 14.7612 8.97626 11.7393 9.16358 5.50031 12.9795 4.91785 6.43582 7.92304 numMergedOcc 0
9 mol 155 unq 2 iso 0 dist 8.99128 14.7612 8.97626 10.7516 9.24038 6.89781 17.1751 9.16779 7.46303 10.9606 numMergedOcc 0
10 mol 155 unq 3 iso 0 dist 8.99128 14.7612 8.97626 10.7516 9.24038 6.89781 12.9795 4.91785 6.43582 10.3161 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.76579 6.67469 7.02548 10.1869 8.86449 7.08726 9.06133 11.6011 9.87651 16.4813 numMergedOcc 0
12 mol 170 unq 0 iso 0 dist 9.66676 6.45787 9.51256 4.11212 6.47164 4.34698 9.32245 4.78249 9.76807 6.35982 numMergedOcc 0
13 mol 170 unq 1 iso 0 dist 9.66676 6.45787 9.51256 9.2613 9.65126 5.75144 9.32245 4.78249 9.76807 7.51126 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 5.97971 10.8374 9.01624 7.18433 5.99437 7.20191 7.7544 5.71898 7.81386 9.39829 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 5.97971 10.8374 9.01624 7.18433 5.99437 7.20191 11.1074 5.93724 7.63312 6.41453 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 8.72747 11.9541 9.01624 6.37887 5.99437 7.20191 11.7328 5.71898 7.81386 9.39829 numMergedOcc 0
17 mol 181 unq 3 iso 0 dist 8.72747 11.9541 9.01624 6.37887 5.99437 7.20191 12.2168 5.93724 7.63312 6.41453 numMergedOcc 0
18 mol 181 unq 4 iso 0 dist 8.23845 8.672 9.01624 4.94211 5.99437 7.20191 9.88721 5.71898 7.81386 9.39829 numMergedOcc 0
19 mol 181 unq 5 iso 0 dist 8.23845 8.672 9.01624 4.94211 5.99437 7.20191 10.8515 5.93724 7.63312 6.41453 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 7.99441 9.84386 5.56538 4.07008 8.43195 7.75656 8.86173 6.84862 7.21333 7.67576 numMergedOcc 0
21 mol 222 unq 1 iso 0 dist 6.71817 9.84386 7.48954 4.07008 8.23406 7.75656 8.86173 9.53117 7.21333 7.67576 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.565 6.57808 8.08349 8.65179 5.05368 10.7174 10.2007 5.13732 6.61986 10.0553 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 9.993 13.3838 6.73665 9.08479 8.95511 11.169 17.0305 10.6736 6.16342 11.308 numMergedOcc 0
24 mol 239 unq 1 iso 0 dist 9.993 13.3838 6.73665 15.0274 5.85002 5.88931 17.0305 10.6736 6.16342 10.3435 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 9.63325 16.264 7.20674 12.0583 8.62162 8.83082 16.0338 7.8414 8.2734 14.0973 numMergedOcc 0
