0 mol 36 unq 0 iso 0 dist 7.7124 8.02028 5.70939 12.2454 4.59725 8.41542 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 7.17698 5.09927 8.50003 11.7939 10.0309 7.68478 numMergedOcc 0
2 mol 38 unq 1 iso 0 dist 7.17698 5.09927 8.50003 8.86547 6.37474 6.87122 numMergedOcc 0
3 mol 38 unq 2 iso 0 dist 4.74069 5.09927 7.00717 11.7939 10.622 7.68478 numMergedOcc 0
4 mol 38 unq 3 iso 0 dist 4.74069 5.09927 7.00717 8.86547 6.10572 6.87122 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 6.34748 5.58299 6.51117 8.125 5.16401 9.94407 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 8.23073 6.84485 4.3439 10.1171 4.99174 7.51733 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 8.23073 6.84485 4.3439 14.2142 8.67311 9.01607 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.17216 16.3297 8.60651 13.9365 4.94983 6.79114 numMergedOcc 0
9 mol 152 unq 1 iso 0 dist 9.40483 11.5151 8.60651 13.1463 4.94983 6.79114 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 7.96541 9.69599 7.0961 11.6738 4.67135 7.48734 numMergedOcc 0
11 mol 168 unq 1 iso 0 dist 7.96541 9.69599 7.0961 14.9056 9.87321 5.6125 numMergedOcc 0
12 mol 198 unq 0 iso 0 dist 7.7619 5.46544 7.04521 10.7197 12.1607 9.7657 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.867 15.4168 7.68686 14.4261 8.97813 9.31158 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 9.09697 16.5417 7.99036 13.2462 6.03044 9.57465 numMergedOcc 0
15 mol 251 unq 0 iso 0 dist 6.67075 10.4897 7.72528 13.2248 11.5298 8.45764 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 4.93584 6.91113 9.83672 7.72749 4.74189 8.97531 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 5.60245 11.2811 9.83672 10.0438 4.74189 8.97531 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 9.24101 9.41407 9.56933 13.6276 6.73772 9.93746 numMergedOcc 0
