0 mol 41 unq 0 iso 0 dist 8.45063 6.51139 14.3405 10.7583 7.64235 13.9779 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 8.45063 6.51139 14.3405 6.24565 6.00623 10.1388 numMergedOcc 0
2 mol 41 unq 2 iso 0 dist 8.45063 6.51139 14.3405 5.14132 6.59367 10.8516 numMergedOcc 0
3 mol 41 unq 3 iso 0 dist 8.45063 6.91278 14.4796 10.7583 7.64235 13.8746 numMergedOcc 0
4 mol 41 unq 4 iso 0 dist 8.45063 6.91278 14.4796 6.24565 6.00623 10.148 numMergedOcc 0
5 mol 41 unq 5 iso 0 dist 8.45063 6.91278 14.4796 5.14132 6.59367 9.22814 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 6.71467 8.6338 7.92278 10.2546 9.20885 16.5453 numMergedOcc 0
7 mol 61 unq 1 iso 0 dist 6.71467 7.63159 4.56037 10.2546 9.20885 13.0831 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 5.01633 9.01568 5.19081 8.91765 8.26819 9.24433 numMergedOcc 0
9 mol 116 unq 0 iso 0 dist 7.67429 9.62357 6.42183 4.6158 9.66069 8.31955 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 7.67877 9.48694 8.10796 11.1968 9.17877 15.0211 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 8.61448 5.84909 8.13581 6.2062 6.61636 7.46812 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 9.21476 5.47265 9.82809 5.81847 9.6818 9.80032 numMergedOcc 0
13 mol 165 unq 0 iso 0 dist 9.8446 9.63241 5.54803 12.6809 8.4082 13.7142 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 7.7013 8.57666 4.40729 4.65504 7.77669 10.3725 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 5.31333 6.36789 3.82682 9.58526 5.80433 7.46024 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 5.31333 6.36789 3.82682 11.0885 6.8285 9.88516 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.72578 7.81825 13.7573 6.00114 5.60554 11.512 numMergedOcc 0
18 mol 217 unq 1 iso 0 dist 8.80103 7.81825 3.6199 9.52898 7.89936 8.94871 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 6.87565 8.39315 4.40152 5.19341 5.64376 7.6416 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 9.26313 6.94194 10.483 4.52208 9.88216 10.8605 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 8.55211 9.54363 3.96192 10.3966 7.58405 11.4279 numMergedOcc 0
22 mol 260 unq 1 iso 0 dist 8.55211 9.54363 3.96192 5.51525 7.26115 9.90354 numMergedOcc 0
