0 mol 33 unq 0 iso 0 dist 5.65377 7.77567 5.63669 6.82054 4.41045 8.45145 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 8.05974 8.65918 4.29981 9.35273 8.69452 10.0878 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.61203 7.91401 12.7497 8.0664 7.31881 13.4192 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 8.61203 8.68643 14.4691 8.0664 7.31881 16.338 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.32172 6.88471 3.84261 9.49441 8.39335 9.86479 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 8.93486 8.19547 3.84261 5.15922 8.39335 9.86479 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 9.19143 5.73003 6.21391 9.65792 7.09177 10.6103 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 9.23907 5.21227 6.21391 11.3286 7.09177 10.6103 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 9.61215 7.27898 12.2778 8.3346 8.09682 14.0279 numMergedOcc 0
9 mol 123 unq 1 iso 0 dist 9.61215 7.27898 12.2778 10.1291 8.35926 15.4055 numMergedOcc 0
10 mol 123 unq 2 iso 0 dist 9.61215 7.27898 12.2778 14.6702 7.41568 18.1079 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 9.56967 8.8556 8.61203 5.37694 9.40603 11.341 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 7.66242 8.8556 5.73429 4.99447 8.00223 5.58647 numMergedOcc 0
13 mol 176 unq 2 iso 0 dist 7.66242 8.8556 5.73429 5.46526 9.60695 8.5733 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 5.50393 7.89319 10.5349 14.053 9.79593 19.1825 numMergedOcc 0
15 mol 283 unq 0 iso 0 dist 9.24924 5.34771 8.40497 8.2722 7.17276 9.90494 numMergedOcc 0
16 mol 283 unq 1 iso 0 dist 9.24924 9.2825 8.03948 8.2722 7.17276 5.90121 numMergedOcc 0
17 mol 283 unq 2 iso 0 dist 9.72248 9.40332 8.40497 5.93642 7.17276 9.90494 numMergedOcc 0
18 mol 283 unq 3 iso 0 dist 9.72248 5.8676 8.03948 5.93642 7.17276 5.90121 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.80478 7.86603 6.80232 15.9206 8.15636 12.1774 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 7.80478 7.86603 6.80232 14.0034 7.86292 12.5726 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.80478 7.86603 6.80232 15.9206 8.15636 12.1774 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 7.80478 7.86603 6.80232 14.0034 7.86292 12.5726 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 7.80478 7.86603 6.80232 15.9206 8.15636 12.1774 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 7.80478 7.86603 6.80232 14.0034 7.86292 12.5726 numMergedOcc 0
