0 mol 0 unq 0 iso 0 dist 6.94181 5.47921 7.15528 12.4868 13.3337 7.37981 12.2644 9.46298 7.40865 6.63977 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.94181 5.47921 7.15528 10.9707 6.83587 7.19621 12.2644 9.46298 7.40865 4.76647 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 7.32392 15.5277 9.60499 19.9982 13.823 8.23909 11.9168 8.43473 6.02702 13.7145 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 7.32392 15.5277 9.60499 11.5036 5.38502 6.72215 11.9168 8.43473 6.02702 6.11915 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 6.28033 5.40044 4.7319 7.72142 5.59769 8.47315 9.9153 6.51133 6.72833 12.1062 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 7.53564 10.323 9.74445 11.9521 6.18002 8.95682 10.7304 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.54183 5.65405 8.10861 10.4186 12.4254 6.59893 8.60653 5.99981 7.21717 8.02105 numMergedOcc 0
7 mol 54 unq 1 iso 0 dist 6.54183 5.65405 8.10861 6.10175 10.1356 5.59773 8.60653 5.99981 7.21717 7.93241 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.124 13.4367 6.19304 7.84699 5.2774 6.89722 13.2119 6.56633 9.24757 11.5412 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.124 13.4367 6.19304 8.40844 5.44275 7.26679 13.2119 6.56633 9.24757 11.2253 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 8.16299 10.3774 8.70481 12.1654 13.9156 6.89722 14.1293 15.3808 9.24757 11.5412 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 8.16299 10.3774 8.70481 7.02351 11.2674 7.26679 14.1293 15.3808 9.24757 11.2253 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 8.27015 12.6626 8.70481 15.154 13.9156 6.89722 21.4221 15.3808 9.24757 11.5412 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 8.27015 12.6626 8.70481 13.9009 11.2674 7.26679 21.4221 15.3808 9.24757 11.2253 numMergedOcc 0
14 mol 102 unq 0 iso 0 dist 9.84673 5.09542 7.36792 7.73836 6.42572 9.01767 11.4976 7.42011 8.31932 10.4216 numMergedOcc 0
15 mol 102 unq 1 iso 0 dist 9.84673 5.09542 7.36792 10.8539 5.54551 9.80678 11.4976 7.42011 8.31932 12.8733 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 6.55511 5.47689 5.11551 10.999 5.39296 6.7225 10.0041 6.77806 6.92026 6.39438 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 8.88255 10.5726 8.73993 13.776 14.0677 9.42766 14.0057 7.20179 6.52773 13.1831 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 8.88255 10.5726 8.73993 13.776 14.0677 9.42766 8.61574 9.89358 9.23858 6.34278 numMergedOcc 0
19 mol 156 unq 0 iso 0 dist 9.19499 5.66289 7.44554 6.67598 5.0966 7.30021 10.6749 5.71511 9.4013 9.69888 numMergedOcc 0
20 mol 156 unq 1 iso 0 dist 7.11647 5.66289 8.94056 6.67598 5.75141 7.30021 10.6749 6.13574 9.4013 9.69888 numMergedOcc 0
21 mol 156 unq 2 iso 0 dist 7.98018 4.68187 9.83699 11.5769 12.865 7.30021 9.82618 5.80008 9.4013 9.69888 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 8.90247 14.0828 8.03334 17.8457 9.60754 7.44191 11.3392 4.43096 6.46704 6.70394 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 8.90247 14.0828 8.03334 17.8457 9.60754 7.44191 13.656 8.04639 6.59025 11.2787 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 8.90247 14.0828 8.03334 18.32 11.1879 6.00053 11.3392 4.43096 6.46704 10.8517 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 8.90247 14.0828 8.03334 18.32 11.1879 6.00053 13.656 8.04639 6.59025 5.87168 numMergedOcc 0
26 mol 220 unq 0 iso 0 dist 6.21273 5.1021 9.23153 8.58709 4.90657 9.8711 7.58118 7.11498 6.59716 4.39102 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 8.7419 5.01062 6.00706 7.10689 8.81265 8.7347 13.4892 7.75466 9.07471 15.9714 numMergedOcc 0
28 mol 222 unq 1 iso 0 dist 8.5834 5.01062 7.54212 7.10689 4.28891 8.7347 13.4892 13.3447 9.07471 15.9714 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 12.3036 14.9329 9.17826 11.9075 6.35849 7.43071 16.3489 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 9.60159 7.51316 7.22101 12.3036 14.9329 9.17826 11.7218 10.9607 5.41321 5.75236 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 9.60159 6.38287 7.09863 11.4993 7.69739 9.64299 11.9075 6.35849 6.02296 9.17153 numMergedOcc 0
32 mol 227 unq 3 iso 0 dist 7.71761 5.841 7.55216 7.99145 11.4528 9.17826 11.6367 9.32448 7.43071 16.3489 numMergedOcc 0
33 mol 227 unq 4 iso 0 dist 7.71761 5.841 7.55216 7.99145 11.4528 9.17826 6.65275 6.48027 5.41321 5.75236 numMergedOcc 0
34 mol 239 unq 0 iso 0 dist 6.83046 4.77446 6.16342 4.21935 5.29737 6.37342 10.3104 4.30299 8.84636 7.48655 numMergedOcc 0
35 mol 258 unq 0 iso 0 dist 8.44862 10.4505 6.97229 14.9652 9.49027 5.81927 10.5461 6.7919 7.6595 7.15953 numMergedOcc 0
