0 mol 48 unq 0 iso 0 dist 6.04551 6.31161 9.46719 9.54168 7.98634 15.4748 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 6.01454 8.36915 8.29103 9.26625 8.07681 15.701 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 6.67079 7.14636 5.37162 5.78109 8.64454 6.59252 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 7.14636 6.67079 5.37162 5.78109 6.59252 8.64454 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.30431 4.628 8.0979 9.99186 8.3539 11.6781 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 8.14932 6.17846 8.91253 12.0922 6.53573 14.7981 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.27355 5.39171 5.47475 15.9568 8.91833 12.6162 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.27355 8.60363 4.4628 15.9568 8.91833 13.2626 numMergedOcc 0
8 mol 86 unq 0 iso 0 dist 8.39947 8.39046 11.0575 4.6791 9.18352 12.5488 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 7.96689 4.83134 8.94234 6.68015 6.98375 8.8405 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.6582 5.17734 8.94234 11.3115 6.98375 8.8405 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 4.83134 7.96689 8.94234 6.68015 8.8405 6.98375 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 4.83134 7.96689 8.94234 6.79475 5.80662 13.6942 numMergedOcc 0
13 mol 133 unq 4 iso 0 dist 5.17734 9.6582 8.94234 11.3115 8.8405 6.98375 numMergedOcc 0
14 mol 133 unq 5 iso 0 dist 5.17734 9.6582 8.94234 5.49451 5.80662 13.6942 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 8.82165 7.38622 4.87816 14.302 8.65631 11.9492 numMergedOcc 0
16 mol 230 unq 0 iso 0 dist 7.43793 8.4739 5.27013 4.76236 7.63624 9.95611 numMergedOcc 0
17 mol 230 unq 1 iso 0 dist 8.4739 7.43793 5.27013 4.76236 9.95611 7.63624 numMergedOcc 0
18 mol 245 unq 0 iso 0 dist 8.69377 7.26913 12.3319 9.18706 7.21119 10.9432 numMergedOcc 0
19 mol 245 unq 1 iso 0 dist 8.69377 6.41862 6.22658 9.18706 7.21119 11.4625 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 9.05509 8.57733 6.17591 12.011 9.49976 14.6459 numMergedOcc 0
