0 mol 10 unq 0 iso 0 dist 8.09253 11.9658 7.14537 12.1215 5.04413 9.06457 numMergedOcc 0
1 mol 66 unq 0 iso 0 dist 8.78967 5.1493 9.6145 10.9105 12.9761 9.00438 numMergedOcc 0
2 mol 66 unq 1 iso 0 dist 9.08763 5.1493 8.32859 10.9105 9.94694 9.00438 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.78762 4.43742 9.08825 7.71596 8.66335 8.5069 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 6.63733 10.8503 8.51259 9.60958 6.2804 8.0318 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 7.77418 8.58795 7.31064 9.37708 5.96497 6.88696 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 9.58844 13.9252 7.5573 19.4826 10.0666 9.88678 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 9.58844 13.9252 7.5573 17.5652 9.69908 7.06547 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 7.29835 4.90408 9.79585 10.3369 10.651 7.39651 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.56602 9.00121 5.67168 8.40343 5.21837 7.7734 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 8.41456 9.09562 5.67168 8.09373 5.32701 7.99933 numMergedOcc 0
11 mol 207 unq 0 iso 0 dist 9.93721 9.3941 4.76113 13.204 5.08264 8.72885 numMergedOcc 0
12 mol 207 unq 1 iso 0 dist 6.29106 4.60219 4.76113 11.2022 5.08264 8.72885 numMergedOcc 0
13 mol 207 unq 2 iso 0 dist 8.01415 6.68112 4.76113 4.55528 4.43093 6.06003 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 6.91906 15.4894 9.43017 14.3696 7.78712 5.79617 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 7.61739 7.60854 8.14294 9.91983 6.84149 5.07975 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 7.61739 5.13817 5.72 9.91983 6.84149 4.85015 numMergedOcc 0
17 mol 222 unq 2 iso 0 dist 7.61739 4.54609 6.84052 9.91983 6.84149 8.15345 numMergedOcc 0
18 mol 222 unq 3 iso 0 dist 9.59191 4.54609 9.58086 9.91983 12.7709 8.15345 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 6.50932 7.4921 6.03081 7.52696 5.39025 4.36956 numMergedOcc 0
20 mol 235 unq 1 iso 0 dist 6.50932 4.7126 7.41433 7.52696 5.39025 8.43799 numMergedOcc 0
