0 mol 15 unq 0 iso 0 dist 8.0637 4.89563 5.69927 7.38118 5.70754 8.4014 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 8.44832 4.82342 5.35193 7.34619 12.5188 7.68478 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 8.87569 8.52979 10.8037 10.7036 13.1812 6.22221 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 5.8409 8.40871 7.17843 7.4829 8.48827 7.91148 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 5.8409 8.40871 7.17843 8.47947 7.14048 6.59794 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 5.8409 8.40871 7.17843 5.63389 9.53722 8.34957 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 8.13368 8.40871 4.4651 7.4829 8.03895 7.91148 numMergedOcc 0
7 mol 78 unq 4 iso 0 dist 8.13368 8.40871 4.4651 8.47947 5.68873 6.59794 numMergedOcc 0
8 mol 78 unq 5 iso 0 dist 8.13368 8.40871 4.4651 5.63389 9.84838 8.34957 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.04398 9.80191 4.38811 10.3632 12.1329 8.99912 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 9.35529 9.41521 5.89379 5.79975 9.16089 6.42623 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 9.35529 9.41521 5.89379 12.8646 14.6365 8.95899 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 4.76012 6.1421 6.43966 12.077 14.109 7.97548 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 4.76012 6.1421 6.43966 10.5094 14.2262 9.64164 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 9.87066 6.44766 5.59449 9.62739 13.8709 8.80895 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 8.94007 9.11046 6.91778 5.76262 8.76449 6.73617 numMergedOcc 0
16 mol 147 unq 1 iso 0 dist 8.94007 9.11046 6.91778 4.09924 8.36182 9.03544 numMergedOcc 0
17 mol 168 unq 0 iso 0 dist 8.80094 7.53748 13.1236 4.18108 10.4746 5.6125 numMergedOcc 0
18 mol 168 unq 1 iso 0 dist 9.03681 7.53748 9.8022 4.18108 10.6876 5.6125 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.37765 6.20985 4.94882 3.98361 9.14525 5.90765 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 8.05227 7.18765 7.56497 15.4113 14.0133 9.23086 numMergedOcc 0
21 mol 222 unq 0 iso 0 dist 6.17749 8.81925 4.82768 4.73685 4.90656 5.1609 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 8.15743 6.94983 9.60401 8.26136 11.6863 8.25985 numMergedOcc 0
23 mol 232 unq 1 iso 0 dist 8.15743 6.94983 9.60401 4.7723 12.0387 9.27788 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 9.44043 8.14812 9.07364 6.55101 6.61322 8.03012 numMergedOcc 0
25 mol 270 unq 0 iso 0 dist 4.60602 9.02113 5.00269 9.89802 7.97614 8.65354 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 6.84909 6.02089 9.83514 5.92057 11.7639 9.93746 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 6.84909 6.87804 8.04474 11.4406 11.1568 6.69619 numMergedOcc 0
28 mol 292 unq 2 iso 0 dist 6.84909 6.87804 8.04474 10.8521 10.2196 4.49592 numMergedOcc 0
29 mol 292 unq 3 iso 0 dist 6.38051 6.07571 9.00118 7.86088 13.1327 6.69619 numMergedOcc 0
30 mol 292 unq 4 iso 0 dist 6.38051 6.07571 9.00118 4.34603 9.95781 4.49592 numMergedOcc 0
