0 mol 0 unq 0 iso 0 dist 7.31837 5.66453 6.64713 13.5016 7.16396 9.83355 9.42137 5.24778 6.26831 5.47921 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.99657 13.823 5.71201 16.4756 10.699 7.38646 12.1945 5.67536 9.27637 15.8283 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.44507 14.6525 9.5053 12.9904 6.81961 9.97991 9.7522 10.9837 8.44506 11.1182 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.75211 5.25697 6.66954 13.2925 7.88113 9.42735 8.58841 4.3931 4.79949 6.71804 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 5.94696 11.7159 8.43352 21.0803 17.0061 9.60416 12.3884 7.06961 7.26086 11.8887 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 8.27794 11.393 9.35942 15.7638 14.3305 6.07991 16.414 12.7083 6.34525 9.52181 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 6.66022 5.01124 8.85881 9.94634 5.67542 9.03491 4.98864 5.22052 5.74857 7.12329 numMergedOcc 0
7 mol 126 unq 0 iso 0 dist 8.97111 5.93497 5.94233 10.6754 5.23583 9.31118 8.32241 6.0268 9.46588 5.50061 numMergedOcc 0
8 mol 126 unq 1 iso 0 dist 8.97111 5.93497 5.94233 14.0573 7.25449 8.44104 8.32241 6.0268 9.46588 13.2671 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 9.41073 15.2038 7.25644 23.9361 14.6343 9.95533 19.8549 11.1681 5.49226 5.65454 numMergedOcc 0
10 mol 147 unq 1 iso 0 dist 9.41073 15.2038 7.25644 23.9361 14.6343 9.95533 14.5535 5.50251 6.28351 10.1056 numMergedOcc 0
11 mol 147 unq 2 iso 0 dist 9.41073 15.2038 7.25644 14.4156 5.93581 7.94147 19.8549 11.1681 5.49226 10.4411 numMergedOcc 0
12 mol 147 unq 3 iso 0 dist 9.41073 15.2038 7.25644 14.4156 5.93581 7.94147 14.5535 5.50251 6.28351 6.11262 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 9.69704 9.82329 8.15091 14.0946 8.89634 8.72947 7.15815 5.78064 7.77998 13.1177 numMergedOcc 0
