0 mol 6 unq 0 iso 0 dist 8.07981 8.41625 7.33484 9.87351 11.2186 6.8041 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.12062 9.3613 11.042 10.5928 15.0599 8.58962 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 6.48746 9.5663 7.89444 5.40109 6.23138 9.23947 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.75708 9.23755 6.17006 15.0981 10.163 6.82707 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 9.31349 9.48319 15.0353 10.3314 13.2115 7.65069 numMergedOcc 0
5 mol 83 unq 1 iso 0 dist 7.61666 9.48319 11.9566 10.3314 12.1412 7.65069 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.26954 7.40582 9.5797 16.1172 14.5374 8.96747 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 8.03407 8.98532 8.6267 10.2731 13.0999 6.15654 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 8.03407 8.98532 8.6267 4.66752 10.7591 7.89887 numMergedOcc 0
9 mol 92 unq 3 iso 0 dist 6.39759 8.98532 4.68995 10.2731 9.18898 6.15654 numMergedOcc 0
10 mol 92 unq 4 iso 0 dist 6.39759 8.98532 4.68995 4.66752 7.67331 7.89887 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 9.22411 7.29309 6.98636 5.91879 11.3756 7.48563 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 6.17173 7.29309 4.34199 5.91879 8.41411 7.48563 numMergedOcc 0
13 mol 105 unq 0 iso 0 dist 9.46876 6.88033 5.95661 11.7437 15.1659 9.23757 numMergedOcc 0
14 mol 128 unq 0 iso 0 dist 5.32517 7.94925 10.3732 5.8344 8.87314 6.51968 numMergedOcc 0
15 mol 128 unq 1 iso 0 dist 5.32517 7.94925 10.3732 10.172 14.8285 7.61237 numMergedOcc 0
16 mol 128 unq 2 iso 0 dist 7.6275 7.94925 9.77148 5.8344 10.2256 6.51968 numMergedOcc 0
17 mol 128 unq 3 iso 0 dist 7.6275 7.94925 9.77148 10.172 15.4399 7.61237 numMergedOcc 0
18 mol 128 unq 4 iso 0 dist 7.4738 7.94925 11.4636 5.8344 12.5952 6.51968 numMergedOcc 0
19 mol 128 unq 5 iso 0 dist 7.4738 7.94925 11.4636 10.172 10.3883 7.61237 numMergedOcc 0
20 mol 128 unq 6 iso 0 dist 8.88867 7.94925 3.93522 5.8344 9.49761 6.51968 numMergedOcc 0
21 mol 128 unq 7 iso 0 dist 8.88867 7.94925 3.93522 10.172 6.03154 7.61237 numMergedOcc 0
22 mol 128 unq 8 iso 0 dist 7.04282 7.94925 5.16811 5.8344 9.38436 6.51968 numMergedOcc 0
23 mol 128 unq 9 iso 0 dist 7.04282 7.94925 5.16811 10.172 9.03339 7.61237 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 8.78 5.19029 7.01552 5.16948 9.94824 8.36723 numMergedOcc 0
25 mol 141 unq 0 iso 0 dist 8.47476 8.3097 3.56357 14.894 7.6793 8.71007 numMergedOcc 0
26 mol 141 unq 1 iso 0 dist 6.74947 8.3097 14.4565 14.894 20.9125 8.71007 numMergedOcc 0
27 mol 192 unq 0 iso 0 dist 6.88947 6.6011 8.19854 11.3395 15.3295 7.37823 numMergedOcc 0
28 mol 204 unq 0 iso 0 dist 9.19343 6.58174 7.51586 11.4894 12.8797 9.23676 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 6.62404 5.60195 4.68697 7.03806 7.4513 7.46122 numMergedOcc 0
30 mol 220 unq 1 iso 0 dist 9.37847 7.87359 4.68697 4.69654 7.4513 7.46122 numMergedOcc 0
31 mol 226 unq 0 iso 0 dist 9.31677 6.3687 9.96567 6.62409 12.7784 5.3747 numMergedOcc 0
32 mol 261 unq 0 iso 0 dist 8.07113 9.66298 13.4973 11.7392 14.9602 6.45102 numMergedOcc 0
33 mol 285 unq 0 iso 0 dist 5.77107 4.49395 6.37482 9.67478 8.65334 6.46935 numMergedOcc 0
