0 mol 15 unq 0 iso 0 dist 8.0637 9.60736 5.61111 4.98085 5.19544 6.23015 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.58806 4.71964 9.19871 4.95472 13.3973 6.29797 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 8.94991 9.27894 6.44712 5.85411 5.51406 8.77355 numMergedOcc 0
3 mol 135 unq 0 iso 0 dist 6.29701 6.65965 5.46698 4.14325 5.43728 7.28318 numMergedOcc 0
4 mol 135 unq 1 iso 0 dist 6.29701 6.65965 5.46698 5.67656 9.71735 7.17599 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 7.80661 6.31404 10.7383 5.6686 13.0611 7.58337 numMergedOcc 0
6 mol 159 unq 0 iso 0 dist 8.61918 9.50607 6.30259 15.8252 12.8147 9.35202 numMergedOcc 0
7 mol 168 unq 0 iso 0 dist 8.80094 8.65328 6.97182 7.65643 11.7086 9.85438 numMergedOcc 0
8 mol 168 unq 1 iso 0 dist 9.03681 8.65328 16.9458 7.65643 14.6416 9.85438 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 8.30819 5.98495 9.74745 9.13275 8.81813 5.74846 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.75853 8.30899 13.0046 6.73937 14.8919 8.92115 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 8.78004 9.9922 15.6572 9.50383 17.8482 9.03328 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 9.60654 9.48525 16.0311 10.3075 18.944 9.82043 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 9.60654 9.48525 16.0311 6.06991 14.9773 8.22922 numMergedOcc 0
14 mol 225 unq 2 iso 0 dist 7.11262 9.48525 6.04066 10.3075 13.0845 9.82043 numMergedOcc 0
15 mol 225 unq 3 iso 0 dist 7.11262 9.48525 6.04066 6.06991 9.79196 8.22922 numMergedOcc 0
16 mol 229 unq 0 iso 0 dist 8.17234 9.69367 3.72432 16.0328 9.38362 9.37336 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 8.15743 7.13253 6.54593 4.03628 7.83422 6.59036 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 4.76689 6.54521 6.73886 4.48112 5.68717 9.31888 numMergedOcc 0
19 mol 260 unq 1 iso 0 dist 7.26455 6.54521 5.38205 4.48112 10.4213 9.31888 numMergedOcc 0
20 mol 260 unq 2 iso 0 dist 8.79012 7.97307 9.0549 5.72956 5.68717 6.75725 numMergedOcc 0
