0 mol 0 unq 0 iso 0 dist 6.80636 9.15248 8.31596 10.4388 4.62412 7.92928 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.80636 9.15248 8.31596 16.0765 12.5081 7.48645 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.23213 10.3034 6.3267 12.412 5.96303 7.92928 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 9.23213 10.3034 6.3267 6.26831 4.04089 7.48645 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 8.33604 4.85329 6.26865 7.3915 11.705 9.07858 numMergedOcc 0
5 mol 9 unq 0 iso 0 dist 8.47421 11.4878 7.2199 8.83269 6.81435 9.82483 numMergedOcc 0
6 mol 9 unq 1 iso 0 dist 6.85412 5.60154 9.29529 9.78006 7.98363 8.04924 numMergedOcc 0
7 mol 9 unq 2 iso 0 dist 6.33889 5.60154 7.2199 9.78006 10.4204 8.04924 numMergedOcc 0
8 mol 9 unq 3 iso 0 dist 6.33889 13.7377 8.47109 10.8917 4.71922 7.25684 numMergedOcc 0
9 mol 45 unq 0 iso 0 dist 9.20119 16.2375 8.13782 13.2858 4.52443 7.95778 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 9.58673 6.47744 7.01363 10.5365 6.11542 7.93481 numMergedOcc 0
11 mol 94 unq 0 iso 0 dist 8.3586 10.0455 7.38914 18.7749 15.7837 9.13207 numMergedOcc 0
12 mol 94 unq 1 iso 0 dist 8.3586 10.0455 7.38914 10.5455 5.64735 5.18655 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 6.73814 12.1324 9.86739 14.3116 8.36453 8.06525 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 8.94837 5.9915 6.4218 10.4384 9.10548 8.77898 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 7.77454 10.7186 6.4218 11.1711 9.10548 8.77898 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 7.93331 13.3053 9.79554 13.0111 5.63016 7.79505 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 6.98095 8.94065 9.79554 10.329 5.63016 7.79505 numMergedOcc 0
18 mol 173 unq 2 iso 0 dist 8.31897 14.2537 9.79554 13.4556 5.63016 7.79505 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 9.8589 11.0415 4.79852 12.6297 5.95187 7.01126 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 9.8589 11.0415 4.79852 15.2721 5.46129 6.58434 numMergedOcc 0
21 mol 175 unq 2 iso 0 dist 7.24908 5.0384 4.79852 10.1905 5.95187 7.01126 numMergedOcc 0
22 mol 175 unq 3 iso 0 dist 7.24908 5.0384 4.79852 11.1503 5.46129 6.58434 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 8.53199 7.47048 6.75035 8.06216 5.31559 9.67381 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 8.53199 7.47048 6.75035 5.76954 8.21424 6.61099 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 5.50387 10.7506 8.75834 11.5332 7.15437 5.13453 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 5.50387 10.7506 8.75834 15.6311 15.2958 7.95883 numMergedOcc 0
27 mol 227 unq 0 iso 0 dist 9.62609 8.8709 6.152 5.4694 5.23507 7.89801 numMergedOcc 0
28 mol 227 unq 1 iso 0 dist 8.17891 13.3557 7.95168 8.38865 5.92529 7.89801 numMergedOcc 0
29 mol 227 unq 2 iso 0 dist 6.95902 8.8709 7.95168 5.4694 5.92529 7.89801 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 9.5707 12.1076 9.6101 13.7892 9.66782 9.06084 numMergedOcc 0
31 mol 234 unq 1 iso 0 dist 9.39181 6.29366 5.32183 14.2988 5.3976 9.06084 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 7.20082 6.26168 6.34801 10.2163 10.151 7.18771 numMergedOcc 0
33 mol 250 unq 0 iso 0 dist 8.80086 7.26274 9.88279 13.1352 13.3093 9.03319 numMergedOcc 0
34 mol 272 unq 0 iso 0 dist 7.67853 5.7074 6.75716 9.05222 6.3139 7.35433 numMergedOcc 0
35 mol 282 unq 0 iso 0 dist 9.58517 5.9438 6.73692 8.0241 5.86276 6.353 numMergedOcc 0
