0 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 7.95042 5.69214 4.47891 6.58998 10.7114 9.38831 8.24948 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.86116 6.60423 5.97304 7.95042 5.11636 4.47891 6.58998 6.72502 9.38831 8.24948 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.36323 9.24958 4.33963 7.27472 5.50396 5.11135 10.0655 11.9933 9.58012 7.96195 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.73819 8.60739 5.64171 6.75943 4.96926 4.55347 5.48048 8.44903 7.31982 7.15901 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 5.73819 8.44903 5.48048 6.66407 5.07458 4.69849 5.64171 8.60739 7.31982 7.24352 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 8.80331 9.93832 9.06158 6.6263 5.41726 4.55347 7.05402 10.0649 7.31982 7.15901 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 6.20293 8.60739 9.06158 6.75943 5.41726 4.55347 5.48048 10.0649 7.31982 7.15901 numMergedOcc 0
7 mol 43 unq 4 iso 0 dist 8.93915 8.60739 11.3891 6.75943 10.0383 4.55347 5.48048 13.5072 7.31982 7.15901 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 8.66265 6.77886 6.03623 9.03564 6.75591 10.5332 10.1082 12.6652 13.7148 7.06146 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 7.71338 6.47042 10.0814 8.47988 6.95317 8.90959 8.56707 6.43433 12.0448 4.99604 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.73993 8.56342 4.91132 7.64052 9.68677 6.29394 3.78311 7.77116 8.03035 9.57341 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 8.73993 6.37542 6.08167 7.64052 9.68677 9.64502 3.78311 7.77116 7.6968 9.57341 numMergedOcc 0
12 mol 119 unq 2 iso 0 dist 9.87172 7.99857 7.61939 6.99446 6.20019 6.29394 4.99056 13.1741 8.03035 9.57341 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 5.99315 8.41611 12.7056 5.40637 7.39837 6.16103 10.8441 13.4668 5.73236 8.68663 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 5.99315 7.63338 12.8872 5.40637 7.39837 8.4697 10.8441 13.4668 13.3045 8.68663 numMergedOcc 0
15 mol 143 unq 2 iso 0 dist 5.99315 9.03707 7.76364 5.40637 7.39837 5.41614 10.8441 13.4668 13.3584 8.68663 numMergedOcc 0
16 mol 143 unq 3 iso 0 dist 5.99315 7.25673 9.23795 5.40637 7.39837 6.78032 10.8441 13.4668 15.0441 8.68663 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 5.87555 8.28642 5.70788 6.70693 4.94983 4.71678 5.59336 8.35555 6.39031 7.1069 numMergedOcc 0
18 mol 152 unq 1 iso 0 dist 8.56324 9.77552 9.35627 6.59889 5.39112 4.71678 7.2238 10.4911 6.39031 7.1069 numMergedOcc 0
19 mol 152 unq 2 iso 0 dist 6.70283 8.28642 9.35627 6.70693 5.39112 4.71678 5.59336 10.4911 6.39031 7.1069 numMergedOcc 0
20 mol 152 unq 3 iso 0 dist 8.67331 8.28642 11.2078 6.70693 9.67475 4.71678 5.59336 13.0858 6.39031 7.1069 numMergedOcc 0
21 mol 222 unq 0 iso 0 dist 6.00706 8.48341 6.03524 6.74196 8.84507 9.0716 6.42798 7.862 12.5422 7.97027 numMergedOcc 0
22 mol 222 unq 1 iso 0 dist 6.00706 8.48341 6.03524 8.36842 6.02502 10.5383 6.42798 7.862 12.5422 4.9876 numMergedOcc 0
23 mol 222 unq 2 iso 0 dist 7.54212 8.48341 7.60395 6.74196 12.8595 9.0716 6.42798 12.5287 12.5422 7.97027 numMergedOcc 0
24 mol 222 unq 3 iso 0 dist 7.54212 8.48341 7.60395 8.36842 12.5866 10.5383 6.42798 12.5287 12.5422 4.9876 numMergedOcc 0
25 mol 227 unq 0 iso 0 dist 7.22101 8.38865 11.0628 5.23634 5.0317 7.3164 10.5813 8.03442 9.56257 9.43618 numMergedOcc 0
26 mol 227 unq 1 iso 0 dist 8.65997 5.4694 11.0628 6.91318 5.0317 7.3164 7.22396 8.03442 9.56257 9.43618 numMergedOcc 0
27 mol 227 unq 2 iso 0 dist 7.09863 8.38865 12.9587 5.23634 5.83175 7.3164 10.5813 12.2278 9.56257 9.43618 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 9.45496 7.5366 5.63086 7.81215 12.4252 11.0592 11.113 18.9709 15.2617 9.08151 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 6.7625 7.5366 5.6819 7.81215 5.75498 11.0592 11.113 11.968 15.2617 9.08151 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 5.72887 7.32982 12.3808 9.72188 7.06793 13.0611 10.7551 11.2809 9.89583 6.53286 numMergedOcc 0
31 mol 252 unq 0 iso 0 dist 7.19638 6.86945 5.25252 7.15764 7.40852 4.34126 13.9054 10.7615 11.8525 9.39658 numMergedOcc 0
32 mol 252 unq 1 iso 0 dist 7.19638 6.86945 5.25252 7.15764 7.40852 4.34126 7.63376 7.50201 8.55481 5.9974 numMergedOcc 0
33 mol 264 unq 0 iso 0 dist 9.17653 6.14323 13.0621 8.29262 10.7813 5.82131 9.37297 15.2775 5.74568 6.02757 numMergedOcc 0
