0 mol 75 unq 0 iso 0 dist 7.9233 9.23701 9.4871 11.6939 6.71323 8.79595 numMergedOcc 0
1 mol 119 unq 0 iso 0 dist 7.99857 4.55137 8.81779 9.11344 6.96805 7.84768 numMergedOcc 0
2 mol 119 unq 1 iso 0 dist 8.56342 6.42493 8.81779 6.52773 6.96805 7.84768 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 9.02318 5.29844 6.49708 13.2171 10.8643 8.03721 numMergedOcc 0
4 mol 148 unq 1 iso 0 dist 9.02318 5.29844 6.49708 13.4961 7.23332 9.87021 numMergedOcc 0
5 mol 148 unq 2 iso 0 dist 9.02318 5.29844 6.49708 10.8708 7.89336 7.34023 numMergedOcc 0
6 mol 148 unq 3 iso 0 dist 9.74542 6.55924 6.49708 11.7373 10.8643 8.03721 numMergedOcc 0
7 mol 148 unq 4 iso 0 dist 9.74542 6.55924 6.49708 9.91993 7.23332 9.87021 numMergedOcc 0
8 mol 148 unq 5 iso 0 dist 9.74542 6.55924 6.49708 6.22055 7.89336 7.34023 numMergedOcc 0
9 mol 148 unq 6 iso 0 dist 7.97543 9.61708 6.49708 16.8103 10.8643 8.03721 numMergedOcc 0
10 mol 148 unq 7 iso 0 dist 7.97543 9.61708 6.49708 12.1227 7.23332 9.87021 numMergedOcc 0
11 mol 148 unq 8 iso 0 dist 7.97543 9.61708 6.49708 11.2961 7.89336 7.34023 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 9.6606 6.62435 6.45018 11.8199 11.0516 8.13558 numMergedOcc 0
13 mol 150 unq 1 iso 0 dist 9.6606 6.62435 6.45018 9.96691 7.35366 9.96938 numMergedOcc 0
14 mol 150 unq 2 iso 0 dist 9.6606 6.62435 6.45018 6.14675 7.86976 7.35268 numMergedOcc 0
15 mol 150 unq 3 iso 0 dist 7.85526 9.72618 6.45018 16.9791 11.0516 8.13558 numMergedOcc 0
16 mol 150 unq 4 iso 0 dist 7.85526 9.72618 6.45018 12.1516 7.35366 9.96938 numMergedOcc 0
17 mol 150 unq 5 iso 0 dist 7.85526 9.72618 6.45018 11.2313 7.86976 7.35268 numMergedOcc 0
18 mol 150 unq 6 iso 0 dist 8.94552 5.50847 6.45018 13.5363 11.0516 8.13558 numMergedOcc 0
19 mol 150 unq 7 iso 0 dist 8.94552 5.50847 6.45018 13.6809 7.35366 9.96938 numMergedOcc 0
20 mol 150 unq 8 iso 0 dist 8.94552 5.50847 6.45018 10.9703 7.86976 7.35268 numMergedOcc 0
21 mol 163 unq 0 iso 0 dist 8.38738 10.1139 7.27002 15.035 15.9955 9.54144 numMergedOcc 0
22 mol 163 unq 1 iso 0 dist 8.38738 10.1139 7.27002 17.079 12.9415 6.98345 numMergedOcc 0
23 mol 163 unq 2 iso 0 dist 8.38738 10.1139 7.27002 13.4342 5.87447 7.49813 numMergedOcc 0
24 mol 171 unq 0 iso 0 dist 7.71426 8.62666 7.75632 5.93786 6.29877 6.73995 numMergedOcc 0
25 mol 171 unq 1 iso 0 dist 5.10618 11.8746 7.75632 8.24693 6.29877 6.73995 numMergedOcc 0
26 mol 171 unq 2 iso 0 dist 9.86681 9.0509 7.75632 13.8551 6.29877 6.73995 numMergedOcc 0
27 mol 186 unq 0 iso 0 dist 7.28841 6.67453 7.9637 11.0128 5.80425 7.51714 numMergedOcc 0
28 mol 210 unq 0 iso 0 dist 5.37446 7.09658 9.40123 7.10826 7.1777 9.69053 numMergedOcc 0
29 mol 225 unq 0 iso 0 dist 8.87609 11.7207 9.18343 10.8091 8.98957 7.93342 numMergedOcc 0
30 mol 240 unq 0 iso 0 dist 9.47583 11.6095 7.35934 15.2806 8.23234 9.72504 numMergedOcc 0
31 mol 240 unq 1 iso 0 dist 8.44909 11.9494 7.35934 15.9329 8.23234 9.72504 numMergedOcc 0
32 mol 251 unq 0 iso 0 dist 8.01198 7.703 6.12282 13.3303 7.04387 7.81441 numMergedOcc 0
33 mol 278 unq 0 iso 0 dist 7.67245 7.0588 7.92718 10.3267 10.6303 9.51705 numMergedOcc 0
34 mol 278 unq 1 iso 0 dist 9.12395 3.65013 7.92718 11.9684 10.6303 9.51705 numMergedOcc 0
