0 mol 59 unq 0 iso 0 dist 5.41134 6.65344 6.34748 5.29688 9.05547 6.85766 10.4897 10.5678 6.71911 7.29033 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 5.41134 6.65344 6.34748 13.1729 13.5562 7.71095 10.4897 10.5678 6.71911 5.33688 numMergedOcc 0
2 mol 59 unq 2 iso 0 dist 9.23605 6.65344 13.0793 5.29688 12.9592 6.85766 10.4897 15.449 6.71911 7.29033 numMergedOcc 0
3 mol 59 unq 3 iso 0 dist 9.23605 6.65344 13.0793 13.1729 19.6226 7.71095 10.4897 15.449 6.71911 5.33688 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 5.01633 6.95595 5.56574 12.7957 13.0751 7.79912 8.91765 8.26819 5.15851 10.0425 numMergedOcc 0
5 mol 75 unq 1 iso 0 dist 5.01633 6.95595 5.56574 10.309 12.1692 8.56639 8.91765 8.26819 5.15851 11.8774 numMergedOcc 0
6 mol 75 unq 2 iso 0 dist 5.01633 6.95595 5.56574 5.80162 10.0315 8.59017 8.91765 8.26819 5.15851 10.0372 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 8.32885 8.88225 6.51657 8.73453 13.9582 9.5497 14.1743 13.6852 7.79359 9.68893 numMergedOcc 0
8 mol 86 unq 1 iso 0 dist 9.14653 9.49308 6.51657 10.7693 13.9582 9.5497 12.091 13.6852 7.79359 9.68893 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 5.74637 7.74197 13.1838 4.0486 7.76275 9.36773 10.0278 15.1128 8.66514 8.4283 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 5.74637 7.74197 13.1838 4.0486 7.76275 9.36773 8.37153 13.0642 9.25235 5.37521 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 4.69402 5.86531 6.25005 6.26797 10.4155 7.11802 5.80615 9.63985 7.92688 4.68409 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 4.69402 5.86531 6.25005 9.73435 11.4588 8.00618 5.80615 9.63985 7.92688 12.2037 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 7.97183 5.96555 4.25942 4.6995 9.82156 6.03031 12.5517 13.0315 9.19704 8.66809 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 7.97183 5.96555 4.25942 10.7091 10.4618 7.26832 12.5517 13.0315 9.19704 6.23291 numMergedOcc 0
15 mol 205 unq 2 iso 0 dist 7.97183 5.96555 4.25942 5.87892 9.3629 7.80463 12.5517 13.0315 9.19704 13.231 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.65468 7.16386 9.18673 9.02283 16.5614 9.41367 3.90017 10.8855 7.61951 7.08796 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 9.24066 7.46434 7.87385 13.0285 15.1742 8.41436 4.21173 11.004 6.16063 11.3297 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 9.24066 7.46434 7.87385 13.9912 16.4929 8.92474 4.21173 11.004 6.16063 10.2563 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.29888 9.13537 9.76195 10.3859 15.3066 6.57393 6.16476 11.1838 5.38637 6.20606 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 6.70414 9.29635 5.77904 10.8075 8.35794 9.7748 13.8592 11.7564 9.41725 6.58374 numMergedOcc 0
