0 mol 53 unq 0 iso 0 dist 9.26043 4.44768 6.64564 5.86778 9.52717 3.86331 7.08383 6.98616 8.27455 11.3246 numMergedOcc 0
1 mol 123 unq 0 iso 0 dist 7.99359 4.99882 8.56386 7.21006 8.40918 10.941 7.25497 5.8424 8.71274 10.5825 numMergedOcc 0
2 mol 129 unq 0 iso 0 dist 7.28273 4.65559 7.13958 3.50174 4.4077 3.54691 11.2697 5.0466 9.0455 7.84813 numMergedOcc 0
3 mol 129 unq 1 iso 0 dist 7.28273 4.65559 7.13958 3.98945 8.4874 5.56761 11.2697 5.0466 9.0455 12.1544 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.13344 6.45157 4.69402 4.88335 6.67937 5.56456 5.7232 6.49614 7.12336 8.52036 numMergedOcc 0
5 mol 233 unq 0 iso 0 dist 6.50096 3.63541 8.20598 6.41178 8.2484 3.4982 6.01193 4.69192 9.06304 10.4612 numMergedOcc 0
6 mol 233 unq 1 iso 0 dist 9.91416 6.30963 8.20598 9.33444 8.2484 3.4982 7.40749 4.69192 9.06304 10.4612 numMergedOcc 0
7 mol 246 unq 0 iso 0 dist 8.94816 5.6775 7.63397 4.83796 9.03834 8.86898 10.3787 9.48524 4.82671 13.526 numMergedOcc 0
8 mol 287 unq 0 iso 0 dist 9.04355 12.8871 6.76192 4.12505 9.31611 11.7613 7.90634 5.66584 9.39409 6.16127 numMergedOcc 0
9 mol 288 unq 0 iso 0 dist 9.04355 12.8871 6.76192 4.12505 9.31611 11.7613 7.90634 5.66584 9.39409 6.16127 numMergedOcc 0
10 mol 289 unq 0 iso 0 dist 9.04355 12.8871 6.76192 4.12505 9.31611 11.7613 7.90634 5.66584 9.39409 6.16127 numMergedOcc 0
11 mol 294 unq 0 iso 0 dist 9.23009 9.32276 5.71656 10.0567 8.32582 3.83842 16.1746 10.8049 8.89372 12.0796 numMergedOcc 0
