0 mol 28 unq 0 iso 0 dist 6.75443 8.85208 13.1749 6.18197 8.48456 7.27726 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 6.75443 9.04974 9.39491 6.18197 8.48456 13.3694 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 7.84283 5.66828 3.97968 11.6544 8.71168 7.27726 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 9.02508 8.85208 17.8219 13.6562 7.24073 21.6096 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 9.02508 9.04974 13.3085 13.6562 7.24073 19.9352 numMergedOcc 0
5 mol 28 unq 5 iso 0 dist 9.04621 7.61643 15.7682 10.4653 8.24422 17.84 numMergedOcc 0
6 mol 28 unq 6 iso 0 dist 9.04621 7.61643 15.7682 5.51879 8.99724 12.5462 numMergedOcc 0
7 mol 28 unq 7 iso 0 dist 8.44081 8.85208 15.7682 12.3614 8.24422 17.84 numMergedOcc 0
8 mol 28 unq 8 iso 0 dist 8.44081 8.85208 15.7682 9.5295 8.99724 12.5462 numMergedOcc 0
9 mol 28 unq 9 iso 0 dist 8.44081 9.04974 9.64016 12.3614 8.24422 16.8849 numMergedOcc 0
10 mol 28 unq 10 iso 0 dist 8.44081 9.04974 9.64016 9.5295 8.99724 14.4674 numMergedOcc 0
11 mol 99 unq 0 iso 0 dist 8.0642 9.49001 5.25531 6.09006 9.02059 8.6681 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 5.72842 9.25746 7.2371 6.69867 8.09751 13.3739 numMergedOcc 0
13 mol 103 unq 0 iso 0 dist 7.4348 9.907 10.1932 13.5908 8.88401 15.7556 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 5.09285 8.14574 8.76178 13.76 8.75093 13.5135 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.3164 8.99568 10.627 13.1055 4.62366 14.4334 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 8.63202 7.38306 9.88447 6.94063 4.59484 9.52328 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 6.84692 7.95378 4.56036 7.26324 8.92121 11.5451 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 8.67571 8.92649 5.4733 4.84723 8.89435 9.96797 numMergedOcc 0
19 mol 271 unq 0 iso 0 dist 7.88092 8.56431 10.0049 6.04262 5.76281 12.6608 numMergedOcc 0
