0 mol 0 unq 0 iso 0 dist 9.94248 16.5727 9.23213 5.22416 8.66548 12.9149 14.3653 5.08793 9.6994 12.5416 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.94248 16.5727 9.23213 5.22416 8.66548 12.9149 19.297 10.4498 7.15528 15.8082 numMergedOcc 0
2 mol 86 unq 0 iso 0 dist 9.54683 4.98527 7.79359 6.23998 5.88159 5.9022 14.315 9.68893 9.5497 12.2025 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 9.03277 10.8983 6.89257 10.2401 8.9677 7.52422 17.2149 8.84655 8.70949 13.7122 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.25207 14.4683 7.92688 10.5534 9.10003 14.8533 11.5008 4.68409 7.11802 13.5288 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 8.25207 14.4683 7.92688 10.5534 9.10003 14.8533 18.0344 12.2037 8.00618 20.9604 numMergedOcc 0
6 mol 175 unq 0 iso 0 dist 6.84347 12.1089 9.31887 9.36968 9.76114 5.00913 17.1425 11.0415 9.0018 13.6764 numMergedOcc 0
7 mol 175 unq 1 iso 0 dist 6.84347 12.1089 9.31887 9.36968 9.76114 5.00913 11.1504 5.0384 7.652 10.1305 numMergedOcc 0
8 mol 182 unq 0 iso 0 dist 9.23118 5.40949 6.73313 9.16709 5.73635 4.88992 7.86625 11.1088 9.31746 13.5224 numMergedOcc 0
9 mol 214 unq 0 iso 0 dist 6.35728 10.644 7.46831 4.112 8.70987 11.1534 8.49704 6.67959 8.85478 7.46481 numMergedOcc 0
10 mol 224 unq 0 iso 0 dist 8.77324 5.19217 8.19953 5.52416 5.73591 5.13732 13.1546 8.64911 9.40098 11.2501 numMergedOcc 0
11 mol 224 unq 1 iso 0 dist 8.77324 5.19217 8.19953 5.52416 5.73591 5.13732 11.3126 10.7113 6.61986 8.08349 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 8.11377 5.70988 9.62609 16.099 9.8009 14.6485 13.9401 14.6185 8.65997 15.9467 numMergedOcc 0
13 mol 227 unq 1 iso 0 dist 8.34104 14.9329 8.17891 15.7465 7.79951 4.1511 9.17826 6.43754 7.22101 9.91384 numMergedOcc 0
14 mol 227 unq 2 iso 0 dist 8.34104 14.9329 8.17891 15.7465 7.79951 4.1511 13.0242 9.13836 7.09863 10.3016 numMergedOcc 0
15 mol 227 unq 3 iso 0 dist 8.34104 13.2783 6.95902 15.7465 7.79951 4.69247 9.17826 6.43754 8.65997 9.91384 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.60471 5.47633 9.58736 13.3458 7.02029 13.7306 9.94654 9.66021 5.4638 13.8176 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 5.12523 5.1874 7.97444 4.43818 9.23897 5.58776 9.696 6.8406 8.49997 12.9576 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 5.2527 4.85461 6.85028 6.51505 7.52924 4.57104 9.63346 6.3384 8.04483 10.2229 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 5.2527 8.85797 7.32347 6.51505 7.52924 5.29852 9.63346 6.3384 6.33524 10.2229 numMergedOcc 0
