0 mol 2 unq 0 iso 0 dist 7.99162 5.59831 6.35342 9.76215 12.506 6.52386 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.28341 12.5091 8.39221 11.467 5.63648 9.42142 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 5.84326 4.88072 6.80741 7.68259 4.61096 9.60995 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 5.50504 5.25196 9.62468 6.01552 4.90701 9.67403 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 5.50504 5.25196 9.62468 12.1428 16.7918 7.28917 numMergedOcc 0
5 mol 61 unq 2 iso 0 dist 5.50504 6.97911 5.92705 12.9321 7.49081 9.82315 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.8079 11.4622 4.98104 14.2664 7.17015 6.78043 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 9.8079 11.4622 4.98104 13.7767 4.52119 5.74364 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 8.3558 5.38868 4.98104 8.03407 7.17015 6.78043 numMergedOcc 0
9 mol 92 unq 3 iso 0 dist 8.3558 5.38868 4.98104 6.39759 4.52119 5.74364 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.23803 5.20171 9.74643 5.93206 4.93112 7.66832 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 9.23803 5.20171 9.74643 7.73529 10.5733 8.11083 numMergedOcc 0
12 mol 109 unq 2 iso 0 dist 8.05028 5.20171 6.86702 5.93206 4.48038 7.66832 numMergedOcc 0
13 mol 109 unq 3 iso 0 dist 8.05028 5.20171 6.86702 7.73529 4.76017 8.11083 numMergedOcc 0
14 mol 110 unq 0 iso 0 dist 9.9633 9.40358 7.21229 11.8538 6.12546 6.70591 numMergedOcc 0
15 mol 110 unq 1 iso 0 dist 9.9633 9.40358 7.21229 10.9846 9.24029 5.43052 numMergedOcc 0
16 mol 110 unq 2 iso 0 dist 7.77678 11.5698 5.25492 14.0501 6.39786 6.70591 numMergedOcc 0
17 mol 110 unq 3 iso 0 dist 7.77678 11.5698 5.25492 15.9427 8.50777 5.43052 numMergedOcc 0
18 mol 155 unq 0 iso 0 dist 8.00286 5.88616 7.02715 10.9458 9.88413 6.53806 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 9.74465 12.774 6.00053 13.5174 4.11061 4.96259 numMergedOcc 0
20 mol 188 unq 0 iso 0 dist 7.24099 5.13959 9.24118 8.72253 4.04545 8.48582 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 7.70631 16.2482 8.64255 20.4209 13.0113 5.79753 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 7.70631 16.2482 8.64255 10.3021 4.57437 7.56537 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 8.57514 8.21257 8.43584 10.3051 4.78067 6.09754 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 6.11505 5.03046 8.43584 5.91079 4.78067 6.09754 numMergedOcc 0
25 mol 213 unq 0 iso 0 dist 9.73691 11.0017 4.58599 14.1784 4.67262 5.01229 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 9.66521 5.34424 9.18675 10.9438 10.9746 6.14732 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 5.60236 7.33514 9.71281 13.1376 13.1002 6.71398 numMergedOcc 0
28 mol 235 unq 1 iso 0 dist 9.03917 10.7399 9.71281 13.1156 13.1002 6.71398 numMergedOcc 0
29 mol 241 unq 0 iso 0 dist 8.23536 4.56189 9.72526 11.2123 9.87799 8.15897 numMergedOcc 0
30 mol 241 unq 1 iso 0 dist 6.90245 10.121 9.72526 12.4569 9.87799 8.15897 numMergedOcc 0
31 mol 264 unq 0 iso 0 dist 9.07206 5.7123 6.28512 12.3056 4.75604 8.05522 numMergedOcc 0
32 mol 264 unq 1 iso 0 dist 9.07206 5.7123 6.28512 12.9646 12.5841 9.8799 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 9.38793 12.7183 6.60309 11.9354 5.58906 7.52227 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 9.91518 5.49004 9.82774 8.79625 13.5373 6.83278 numMergedOcc 0
