0 mol 18 unq 0 iso 0 dist 6.72533 8.95294 9.13179 12.5254 14.8325 9.35863 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.72533 8.95294 9.13179 4.95319 8.43157 5.04478 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 8.29216 7.19022 9.13179 7.25833 14.8325 9.35863 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 8.29216 7.19022 9.13179 6.19959 8.43157 5.04478 numMergedOcc 0
4 mol 32 unq 0 iso 0 dist 8.89682 6.76514 8.39998 11.5622 12.3818 8.74576 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 6.41105 9.0321 6.64721 5.29991 5.9443 5.28732 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 8.26291 6.16039 12.2551 6.20277 13.5595 8.9677 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 6.4922 8.28362 6.72936 4.87576 10.1741 8.50502 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 6.4922 5.60137 5.46508 4.87576 10.1741 6.68164 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 9.70186 9.15536 9.36129 6.48113 10.5474 9.76114 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 5.13722 7.95111 11.1645 11.7525 15.5169 7.59939 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 7.68078 5.57537 6.25938 4.3844 8.36019 6.49938 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 7.68078 5.57537 6.25938 6.85132 7.30805 5.87339 numMergedOcc 0
13 mol 210 unq 2 iso 0 dist 9.26518 5.57537 12.7024 4.3844 13.4699 6.49938 numMergedOcc 0
14 mol 210 unq 3 iso 0 dist 9.26518 5.57537 12.7024 6.85132 16.0649 5.87339 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.64455 5.77917 7.72105 10.7932 12.7463 8.70987 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.01565 6.31114 7.4709 11.531 16.9023 9.74902 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.36655 8.50767 11.5371 5.03816 8.9352 6.0283 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 8.76889 6.10834 7.28266 7.51644 5.8845 6.0283 numMergedOcc 0
19 mol 279 unq 2 iso 0 dist 7.04397 8.24233 7.28266 3.75346 5.8845 6.0283 numMergedOcc 0
20 mol 279 unq 3 iso 0 dist 6.37469 6.10834 5.191 7.51644 10.122 6.0283 numMergedOcc 0
