0 mol 24 unq 0 iso 0 dist 8.15652 8.23069 4.93188 7.40392 4.33963 5.54419 8.59466 9.24958 12.3067 7.36323 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.15652 8.59466 9.24958 7.40392 4.33963 7.36323 8.23069 4.93188 12.3067 5.54419 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.44893 9.67461 4.93188 10.6551 4.33963 5.54419 14.0586 9.24958 12.3067 7.36323 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.44893 14.0586 9.24958 10.6551 4.33963 7.36323 9.67461 4.93188 12.3067 5.54419 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.17687 14.4151 9.93832 14.9853 9.06158 8.80331 10.3283 8.60739 8.13395 6.20293 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 9.17687 10.3283 8.60739 14.9853 9.06158 6.20293 14.4151 9.93832 8.13395 8.80331 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 5.9819 6.84034 9.92283 12.6327 17.3924 9.60462 11.8668 14.242 7.05226 7.45389 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.37793 13.2145 6.76699 9.00172 5.74088 6.29155 15.719 11.1595 7.81217 6.80239 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 8.37793 13.2145 6.76699 9.00172 5.74088 6.29155 14.0905 10.5656 11.965 8.00618 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 5.8367 13.0109 8.20836 9.87619 9.4027 8.94367 14.1608 10.873 5.49782 6.37586 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 5.8367 13.0109 8.20836 9.87619 9.4027 8.94367 15.8368 13.846 8.80819 6.49416 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 5.8367 13.0109 8.20836 5.79157 5.12325 9.86662 14.1608 10.873 5.49782 9.71307 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 9.88251 14.4147 8.44861 13.4053 5.28092 6.03031 13.9684 5.60393 7.38516 7.26832 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 9.88251 14.4147 8.44861 13.4053 5.28092 6.03031 14.3112 11.3521 8.18714 7.80463 numMergedOcc 0
14 mol 205 unq 2 iso 0 dist 9.88251 13.9684 5.60393 13.4053 5.28092 7.26832 14.4147 8.44861 7.38516 6.03031 numMergedOcc 0
15 mol 205 unq 3 iso 0 dist 9.88251 13.9684 5.60393 13.4053 5.28092 7.26832 14.3112 11.3521 13.8543 7.80463 numMergedOcc 0
16 mol 229 unq 0 iso 0 dist 7.09453 9.84917 8.92743 11.2852 9.62106 7.03423 5.14312 9.45972 6.84129 9.06952 numMergedOcc 0
17 mol 229 unq 1 iso 0 dist 8.69109 15.4506 8.92743 16.7227 9.62106 7.03423 12.1787 9.45972 6.84129 9.06952 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 9.33359 12.8358 8.50331 16.0063 7.22918 9.81562 18.4732 11.9847 7.28249 8.03456 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 9.33359 12.8358 8.50331 17.4517 9.05842 7.68742 18.4732 11.9847 7.28249 6.84306 numMergedOcc 0
20 mol 236 unq 2 iso 0 dist 9.33359 12.8358 8.50331 8.95071 7.00028 6.27581 18.4732 11.9847 7.28249 9.99038 numMergedOcc 0
21 mol 248 unq 0 iso 0 dist 9.97871 5.8982 6.17052 10.1466 5.99459 7.69895 6.17735 9.77666 5.55137 7.21521 numMergedOcc 0
22 mol 248 unq 1 iso 0 dist 9.97871 5.8982 6.17052 10.1466 5.99459 7.69895 9.38145 13.0539 10.8081 8.2965 numMergedOcc 0
23 mol 248 unq 2 iso 0 dist 9.97871 6.17735 9.77666 10.1466 5.99459 7.21521 5.8982 6.17052 5.55137 7.69895 numMergedOcc 0
24 mol 248 unq 3 iso 0 dist 9.97871 6.17735 9.77666 10.1466 5.99459 7.21521 9.38145 13.0539 5.86196 8.2965 numMergedOcc 0
25 mol 248 unq 4 iso 0 dist 9.08064 7.63032 6.17052 7.40475 5.99459 7.69895 6.42334 9.77666 5.55137 7.21521 numMergedOcc 0
26 mol 248 unq 5 iso 0 dist 9.08064 7.63032 6.17052 7.40475 5.99459 7.69895 6.86606 13.0539 10.8081 8.2965 numMergedOcc 0
27 mol 248 unq 6 iso 0 dist 9.08064 6.42334 9.77666 7.40475 5.99459 7.21521 7.63032 6.17052 5.55137 7.69895 numMergedOcc 0
28 mol 248 unq 7 iso 0 dist 9.08064 6.42334 9.77666 7.40475 5.99459 7.21521 6.86606 13.0539 5.86196 8.2965 numMergedOcc 0
29 mol 252 unq 0 iso 0 dist 8.62351 6.79111 8.47784 6.17985 5.89666 8.1148 6.02958 12.0482 6.0987 8.33025 numMergedOcc 0
30 mol 252 unq 1 iso 0 dist 8.62351 6.79111 8.47784 11.8637 10.672 8.1715 6.02958 12.0482 6.0987 9.2288 numMergedOcc 0
31 mol 252 unq 2 iso 0 dist 9.45457 9.00146 6.86945 12.196 5.25252 7.19638 20.3638 12.322 14.9102 8.33025 numMergedOcc 0
32 mol 252 unq 3 iso 0 dist 9.45457 9.00146 6.86945 12.196 5.25252 7.19638 19.9538 12.2615 11.7918 9.2288 numMergedOcc 0
33 mol 252 unq 4 iso 0 dist 9.44744 11.8815 6.11473 12.6046 9.32326 8.1148 17.2539 10.7615 6.0987 8.33025 numMergedOcc 0
34 mol 252 unq 5 iso 0 dist 9.44744 11.8815 6.11473 14.2581 5.72783 8.1715 17.2539 10.7615 6.0987 9.2288 numMergedOcc 0
35 mol 252 unq 6 iso 0 dist 6.94319 11.8815 8.47784 12.6046 5.89666 8.1148 17.2539 12.0482 6.0987 8.33025 numMergedOcc 0
36 mol 252 unq 7 iso 0 dist 6.94319 11.8815 8.47784 14.2581 10.672 8.1715 17.2539 12.0482 6.0987 9.2288 numMergedOcc 0
37 mol 261 unq 0 iso 0 dist 5.67349 4.63237 5.26434 9.80409 6.04016 9.14619 6.39263 8.60026 7.00201 8.45658 numMergedOcc 0
38 mol 261 unq 1 iso 0 dist 5.67349 6.39263 8.60026 9.80409 6.04016 8.45658 4.63237 5.26434 7.00201 9.14619 numMergedOcc 0
