0 mol 0 unq 0 iso 0 dist 5.98788 7.49611 6.91778 14.2968 10.9859 8.82102 11.0244 9.15528 7.65806 4.87624 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.02286 14.1047 6.44736 8.85869 5.03532 9.85726 19.2577 12.2869 9.60499 11.5784 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.60653 5.65405 7.21717 10.4186 8.02105 6.59893 14.4402 15.293 9.5589 11.9881 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 8.60653 5.65405 7.21717 10.4186 8.02105 6.59893 10.5929 13.86 6.83299 10.3564 numMergedOcc 0
4 mol 54 unq 2 iso 0 dist 8.60653 5.65405 7.21717 10.4186 8.02105 6.59893 6.54183 5.99981 8.10861 12.4254 numMergedOcc 0
5 mol 54 unq 3 iso 0 dist 8.60653 5.65405 7.21717 6.10175 7.93241 5.59773 14.4402 15.293 9.5589 13.9079 numMergedOcc 0
6 mol 54 unq 4 iso 0 dist 8.60653 5.65405 7.21717 6.10175 7.93241 5.59773 10.5929 13.86 6.83299 10.4238 numMergedOcc 0
7 mol 54 unq 5 iso 0 dist 8.60653 5.65405 7.21717 6.10175 7.93241 5.59773 6.54183 5.99981 8.10861 10.1356 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 5.9575 6.23018 6.92026 10.2887 6.39438 6.7225 9.47822 6.77806 5.11551 5.39296 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.21645 11.6494 8.00003 14.448 6.25204 6.49205 16.8793 10.4376 6.18601 5.19198 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 9.57532 12.1367 9.23858 13.2125 6.34278 9.42766 13.63 9.89358 8.73993 14.0677 numMergedOcc 0
11 mol 119 unq 2 iso 0 dist 8.61574 10.5726 9.23858 13.776 6.34278 9.42766 8.88255 9.89358 8.73993 14.0677 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 6.87196 10.9365 7.96646 8.26291 7.91054 7.83619 13.2314 6.73735 9.28393 10.0837 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 6.87196 10.9365 7.96646 17.9497 11.6197 9.91643 13.2314 6.73735 9.28393 7.40242 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 5.43662 5.29825 8.70296 5.50364 4.17212 8.97145 12.0117 14.2045 6.85062 14.257 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 5.43662 5.29825 8.70296 8.7301 9.64263 6.5874 12.0117 14.2045 6.85062 7.60371 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 8.50938 5.32859 6.46704 4.35909 6.70394 7.44191 11.0615 4.43096 8.03334 9.60754 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 8.50938 5.32859 6.46704 5.77393 10.8517 6.00053 11.0615 4.43096 8.03334 11.1879 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 7.58118 5.1021 6.59716 8.58709 4.39102 9.8711 6.21273 7.11498 9.23153 4.90657 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 6.65275 5.841 5.41321 7.99145 5.75236 9.17826 14.1483 10.7656 9.34734 16.2594 numMergedOcc 0
20 mol 227 unq 1 iso 0 dist 6.65275 5.841 5.41321 7.99145 5.75236 9.17826 12.9898 10.9607 7.22101 14.9329 numMergedOcc 0
21 mol 227 unq 2 iso 0 dist 6.65275 5.841 5.41321 7.99145 5.75236 9.17826 14.1659 9.72615 8.65997 13.2783 numMergedOcc 0
22 mol 227 unq 3 iso 0 dist 6.65275 5.841 5.41321 7.99145 5.75236 9.17826 9.8971 5.10635 7.56888 10.6504 numMergedOcc 0
23 mol 227 unq 4 iso 0 dist 6.65275 5.841 5.41321 7.99145 5.75236 9.17826 7.71761 6.48027 7.55216 11.4528 numMergedOcc 0
24 mol 227 unq 5 iso 0 dist 9.90065 9.69354 7.43071 16.2798 16.3489 9.17826 15.2006 6.00424 9.34734 16.2594 numMergedOcc 0
25 mol 227 unq 6 iso 0 dist 9.90065 9.69354 7.43071 16.2798 16.3489 9.17826 13.7795 6.35849 7.22101 14.9329 numMergedOcc 0
26 mol 227 unq 7 iso 0 dist 9.90065 9.69354 7.43071 16.2798 16.3489 9.17826 17.4849 10.204 8.65997 13.2783 numMergedOcc 0
27 mol 227 unq 8 iso 0 dist 9.90065 9.69354 7.43071 16.2798 16.3489 9.17826 14.5325 9.76735 7.56888 10.6504 numMergedOcc 0
28 mol 227 unq 9 iso 0 dist 9.90065 9.69354 7.43071 16.2798 16.3489 9.17826 11.3124 9.32448 7.55216 11.4528 numMergedOcc 0
29 mol 227 unq 10 iso 0 dist 9.90065 7.00512 6.02296 14.2774 9.17153 9.64299 13.7795 6.35849 7.09863 7.69739 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 8.80866 5.44123 7.16525 12.0757 5.81577 7.66519 11.505 4.30004 9.56569 6.42363 numMergedOcc 0
