0 mol 16 unq 0 iso 0 dist 6.28033 5.40044 4.7319 6.64634 7.65889 6.86055 9.9153 6.51133 6.72833 5.94982 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 12.0268 8.09311 11.6226 20.0654 14.012 9.41441 19.932 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.20058 16.6906 8.86116 9.10781 9.05357 13.1949 20.0654 14.012 9.41441 17.7407 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 6.23095 11.5983 6.03987 11.9503 7.6114 5.86705 11.0789 5.68392 6.85556 6.29797 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 4.9903 6.6263 5.41726 11.9521 6.18002 8.95682 10.3764 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 6.7212 11.6369 9.96708 11.1406 9.55118 5.69391 16.4419 11.6378 9.27838 7.58875 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 6.7212 11.6369 9.96708 8.28664 9.10345 13.4212 16.4419 11.6378 9.27838 14.0067 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.124 13.4367 6.19304 15.7072 8.68662 6.20232 13.2119 6.56633 9.24757 8.96616 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.124 13.4367 6.19304 15.2252 7.4369 5.70116 13.2119 6.56633 9.24757 6.14542 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 8.16299 10.3774 8.70481 6.52486 5.5087 11.2069 14.1293 15.3808 9.24757 14.6027 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 8.16299 10.3774 8.70481 10.9731 6.08682 10.6713 14.1293 15.3808 9.24757 13.8591 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 8.27015 12.6626 8.70481 13.0059 5.5087 11.2069 21.4221 15.3808 9.24757 14.6027 numMergedOcc 0
12 mol 73 unq 5 iso 0 dist 8.27015 12.6626 8.70481 14.1533 6.08682 10.6713 21.4221 15.3808 9.24757 13.8591 numMergedOcc 0
13 mol 100 unq 0 iso 0 dist 8.92577 12.0555 7.47343 10.5559 7.82475 5.9143 15.5006 12.2861 8.30845 13.9449 numMergedOcc 0
14 mol 100 unq 1 iso 0 dist 8.92577 12.0555 7.47343 10.5559 7.82475 5.9143 20.027 15.5385 8.76378 10.8812 numMergedOcc 0
15 mol 100 unq 2 iso 0 dist 8.92577 12.0555 7.47343 11.1947 5.35782 5.47563 15.5006 12.2861 8.30845 13.2383 numMergedOcc 0
16 mol 100 unq 3 iso 0 dist 8.92577 12.0555 7.47343 11.1947 5.35782 5.47563 20.027 15.5385 8.76378 11.4348 numMergedOcc 0
17 mol 100 unq 4 iso 0 dist 9.56324 16.8752 7.47343 15.353 7.82475 5.9143 21.1917 12.2861 8.30845 13.9449 numMergedOcc 0
18 mol 100 unq 5 iso 0 dist 9.56324 16.8752 7.47343 15.353 7.82475 5.9143 24.0706 15.5385 8.76378 10.8812 numMergedOcc 0
19 mol 100 unq 6 iso 0 dist 9.56324 16.8752 7.47343 12.9628 5.35782 5.47563 21.1917 12.2861 8.30845 13.2383 numMergedOcc 0
20 mol 100 unq 7 iso 0 dist 9.56324 16.8752 7.47343 12.9628 5.35782 5.47563 24.0706 15.5385 8.76378 11.4348 numMergedOcc 0
21 mol 131 unq 0 iso 0 dist 9.33945 12.3624 8.40312 9.88758 9.27976 3.98662 12.7271 7.7567 9.90168 10.0568 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 7.27598 6.50005 6.37586 4.70162 9.33924 6.95573 9.95528 5.29786 6.23142 12.2587 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 7.27598 6.50005 6.37586 12.487 7.93372 8.06642 9.95528 5.29786 6.23142 9.0176 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 7.27598 12.0971 9.71307 4.70162 9.33924 10.2026 9.95528 5.29786 9.94764 12.2587 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 7.27598 12.0971 9.71307 12.487 7.93372 4.00092 9.95528 5.29786 9.94764 9.0176 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 8.90247 5.114 9.1374 11.9701 9.76212 12.9532 9.99409 8.91338 8.90963 17.8171 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 8.90247 14.0828 8.03334 11.9701 9.76212 6.50233 11.3392 4.43096 6.46704 7.35884 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 8.90247 14.0828 8.03334 11.9701 9.76212 6.50233 13.656 8.04639 6.59025 11.6588 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 5.19262 5.23634 5.0317 11.9075 6.35849 7.43071 9.18728 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 9.60159 7.51316 7.22101 5.19262 5.23634 5.0317 11.7218 10.9607 5.41321 8.91971 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 9.60159 6.38287 7.09863 5.19262 5.23634 5.83175 11.9075 6.35849 6.02296 9.18728 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 9.95045 12.5761 8.27212 13.3209 6.71524 5.10213 11.8822 4.9377 9.40808 9.9183 numMergedOcc 0
33 mol 239 unq 0 iso 0 dist 6.83046 4.77446 6.16342 8.15025 6.73665 10.6736 10.3104 4.30299 8.84636 10.0627 numMergedOcc 0
