0 mol 33 unq 0 iso 0 dist 8.37901 6.24385 8.7979 10.4473 11.8075 7.26522 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 8.8795 6.30619 9.5437 10.3882 5.26208 8.90903 numMergedOcc 0
2 mol 105 unq 0 iso 0 dist 6.1083 12.7631 8.5972 16.1607 10.219 7.29506 numMergedOcc 0
3 mol 105 unq 1 iso 0 dist 6.11833 6.99759 7.29506 13.4095 10.219 8.5972 numMergedOcc 0
4 mol 105 unq 2 iso 0 dist 7.12201 8.04843 7.29506 15.3562 10.219 8.5972 numMergedOcc 0
5 mol 176 unq 0 iso 0 dist 7.98755 10.9549 7.89418 18.4977 17.6558 9.96034 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.91838 10.3155 8.16906 14.3462 7.68915 7.95201 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 7.91838 12.2394 9.14238 14.3462 7.68915 9.39908 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 8.05949 4.60996 8.37216 12.4509 13.2015 8.8066 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 6.39087 8.88074 7.4083 15.9386 12.7921 7.14271 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 6.39087 8.88074 7.4083 10.269 7.27586 8.24411 numMergedOcc 0
11 mol 220 unq 2 iso 0 dist 9.86144 7.46247 7.4083 13.6063 12.7921 7.14271 numMergedOcc 0
12 mol 220 unq 3 iso 0 dist 9.86144 7.46247 7.4083 13.8196 7.27586 8.24411 numMergedOcc 0
13 mol 223 unq 0 iso 0 dist 6.97426 7.84356 8.51763 8.87456 4.71901 5.57309 numMergedOcc 0
14 mol 223 unq 1 iso 0 dist 8.87456 7.84356 5.57309 6.97426 4.71901 8.51763 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 9.24729 5.02022 6.86851 14.5121 13.57 9.88392 numMergedOcc 0
16 mol 268 unq 0 iso 0 dist 5.94741 7.50067 9.7571 12.8423 11.467 8.87745 numMergedOcc 0
