0 mol 7 unq 0 iso 0 dist 5.83658 13.9246 8.23909 10.826 9.60499 13.823 8.14952 4.92824 7.7393 13.7022 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.91266 7.67076 8.73627 4.15151 6.38364 9.18933 7.66311 7.00835 7.54797 8.39221 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.85305 6.71226 6.87871 4.70723 9.24927 8.95909 14.4636 10.4854 9.52614 17.7419 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 8.46734 11.6409 8.21889 6.43998 7.34473 5.5332 17.4496 10.6667 9.0224 13.1633 numMergedOcc 0
4 mol 188 unq 0 iso 0 dist 7.63268 4.54544 6.02561 7.63236 9.96154 5.5682 13.0136 8.53432 9.68317 14.0931 numMergedOcc 0
5 mol 214 unq 0 iso 0 dist 9.40003 10.6403 8.49704 16.5528 9.65138 12.4611 16.7045 13.0236 9.03521 18.3354 numMergedOcc 0
6 mol 214 unq 1 iso 0 dist 9.40003 10.6403 8.49704 9.11345 7.14453 11.832 16.7045 13.0236 9.03521 19.1405 numMergedOcc 0
7 mol 214 unq 2 iso 0 dist 9.40003 10.6403 8.49704 16.922 8.85478 10.644 16.7045 13.0236 9.03521 14.746 numMergedOcc 0
8 mol 214 unq 3 iso 0 dist 8.68385 15.7236 8.49704 10.2443 9.65138 12.4611 17.4715 13.0236 9.03521 18.3354 numMergedOcc 0
9 mol 214 unq 4 iso 0 dist 8.68385 15.7236 8.49704 12.5421 7.14453 11.832 17.4715 13.0236 9.03521 19.1405 numMergedOcc 0
10 mol 214 unq 5 iso 0 dist 8.68385 15.7236 8.49704 9.18071 8.85478 10.644 17.4715 13.0236 9.03521 14.746 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.9077 15.8912 7.31105 10.6943 9.23153 14.6296 7.86207 4.90657 9.58724 9.8711 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 8.9077 15.8912 7.31105 15.396 8.24498 9.52692 7.86207 4.90657 9.58724 12.6756 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 4.79841 6.4556 6.56437 11.4653 8.95269 14.2632 7.62593 5.41021 5.90784 9.33771 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 4.79841 7.70922 9.53131 11.4653 8.95269 9.59595 7.62593 5.41021 8.50322 9.33771 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 6.73134 10.1358 8.77254 5.52669 8.04248 5.74377 12.3547 10.6351 7.34709 10.4926 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 6.73134 10.1358 8.77254 5.27568 8.35971 10.054 12.3547 10.6351 7.34709 8.96717 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 7.15785 6.13416 9.62828 6.5875 8.02547 10.5691 6.41477 4.50761 9.50269 10.2386 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 5.17586 5.72978 8.13489 5.9229 9.70696 5.51096 10.7277 10.2086 9.77593 14.659 numMergedOcc 0
