0 mol 0 unq 0 iso 0 dist 6.28506 7.79297 5.14913 11.9798 13.3779 8.82102 numMergedOcc 0
1 mol 2 unq 0 iso 0 dist 9.76215 7.99162 12.506 6.38677 10.3528 9.58976 numMergedOcc 0
2 mol 2 unq 1 iso 0 dist 9.76215 7.99162 12.506 5.59831 6.52386 6.35342 numMergedOcc 0
3 mol 4 unq 0 iso 0 dist 7.53929 8.66947 10.8758 6.80703 14.0377 9.71908 numMergedOcc 0
4 mol 14 unq 0 iso 0 dist 8.31896 9.28341 4.05028 12.5091 10.2498 8.39221 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 7.7961 6.35333 5.16403 5.97717 11.7135 9.18371 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 7.68259 5.84326 4.61096 4.88072 9.60995 6.80741 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 6.01552 5.50504 4.90701 5.25196 9.67403 9.62468 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 6.01552 5.50504 4.90701 6.97911 9.7314 5.92705 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 7.32868 9.96446 9.29076 14.2688 14.5799 7.86724 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.03407 8.3558 7.17015 5.38868 6.78043 4.98104 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 6.39759 8.3558 4.52119 5.38868 5.74364 4.98104 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 5.93206 9.23803 4.93112 5.20171 7.66832 9.74643 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 5.93206 8.05028 4.48038 5.20171 7.66832 6.86702 numMergedOcc 0
14 mol 109 unq 2 iso 0 dist 7.73529 9.23803 10.5733 5.20171 8.11083 9.74643 numMergedOcc 0
15 mol 109 unq 3 iso 0 dist 7.73529 8.05028 4.76017 5.20171 8.11083 6.86702 numMergedOcc 0
16 mol 122 unq 0 iso 0 dist 8.3907 8.47907 4.42285 6.85647 10.8176 8.33083 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 6.22466 9.52413 11.7795 4.62432 9.80128 7.66381 numMergedOcc 0
18 mol 188 unq 0 iso 0 dist 8.72253 7.24099 4.04545 5.13959 8.48582 9.24118 numMergedOcc 0
19 mol 196 unq 0 iso 0 dist 6.28071 9.36732 9.8977 7.21567 11.6816 6.76923 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 5.91079 6.11505 4.78067 5.03046 6.09754 8.43584 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 4.38586 8.53615 8.65216 14.8014 17.1493 9.84492 numMergedOcc 0
22 mol 241 unq 0 iso 0 dist 5.66945 6.90245 6.72492 10.121 12.3126 9.72526 numMergedOcc 0
23 mol 248 unq 0 iso 0 dist 8.4908 7.40475 11.014 11.0674 17.6356 8.71859 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 6.58667 9.38793 4.84657 12.7183 9.79536 6.60309 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 6.01542 9.38793 13.791 12.7183 18.3648 6.60309 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 8.79625 9.91518 13.5373 5.49004 6.83278 9.82774 numMergedOcc 0
27 mol 278 unq 1 iso 0 dist 9.9609 9.91518 11.4765 5.49004 14.6962 9.82774 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 9.33149 9.82717 4.16039 14.401 12.3495 8.71213 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 5.77107 6.44657 4.16039 14.1417 12.3495 8.71213 numMergedOcc 0
