0 mol 15 unq 0 iso 0 dist 4.89563 7.38118 8.4014 8.0637 5.69927 5.70754 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 8.40871 7.4829 7.91148 5.8409 7.17843 8.48827 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 8.40871 7.4829 7.91148 8.13368 4.4651 8.03895 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 8.40871 8.47947 6.59794 5.8409 7.17843 7.14048 numMergedOcc 0
4 mol 78 unq 3 iso 0 dist 8.40871 8.47947 6.59794 8.13368 4.4651 5.68873 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 9.34456 16.2029 9.59585 10.6138 4.36935 9.86767 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 6.97244 11.3762 7.78789 13.6729 6.7814 9.30187 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 6.97244 10.2106 7.42146 15.0035 11.1675 6.01857 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 9.41521 5.79975 6.42623 9.35529 5.89379 9.16089 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 6.1421 12.077 7.97548 11.3542 5.56946 7.84813 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 9.54663 9.45041 7.97548 13.9359 5.56946 7.84813 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.11046 5.76262 6.73617 8.94007 6.91778 8.76449 numMergedOcc 0
12 mol 147 unq 1 iso 0 dist 9.11046 4.09924 9.03544 8.94007 6.91778 8.36182 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 7.53748 4.18108 5.6125 10.4499 5.81821 6.48066 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 6.20985 3.98361 5.90765 9.37765 4.94882 9.14525 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.69466 6.15845 5.90765 12.1832 4.94882 9.14525 numMergedOcc 0
16 mol 196 unq 0 iso 0 dist 9.29791 6.29625 4.67869 10.8472 4.57882 6.10505 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 8.81925 4.73685 5.1609 6.17749 4.82768 4.90656 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 8.14812 6.55101 8.03012 9.44043 9.07364 6.61322 numMergedOcc 0
19 mol 270 unq 0 iso 0 dist 9.02113 9.89802 8.65354 4.60602 5.00269 7.97614 numMergedOcc 0
