0 mol 16 unq 0 iso 0 dist 9.05346 4.78943 7.03948 6.36377 6.2983 5.05803 6.55076 5.77753 5.38671 8.33883 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.05346 5.48395 5.47769 6.36377 6.2983 6.31718 6.55076 5.77753 5.45161 8.33883 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 7.57958 4.71849 5.81965 11.0291 6.99832 7.4729 15.0054 11.3299 10.7572 4.98104 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 7.57958 13.6329 9.70512 11.0291 6.99832 6.82344 15.0054 11.3299 5.50764 4.98104 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 9.58171 10.4485 6.62561 6.90827 4.91401 7.90328 13.2842 12.907 10.4589 9.85576 numMergedOcc 0
5 mol 117 unq 1 iso 0 dist 9.58171 5.27151 7.63616 6.90827 4.91401 7.83136 13.2842 12.907 14.2649 9.85576 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.95838 5.85391 9.63176 13.3689 10.6679 8.73993 19.8728 19.0836 14.0677 9.42766 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 9.47892 18.2257 9.63176 19.5006 10.6679 8.73993 28.3733 19.0836 14.0677 9.42766 numMergedOcc 0
8 mol 227 unq 0 iso 0 dist 8.42382 7.2593 9.62609 15 14.6185 8.65997 16.1032 13.6158 13.2783 9.17826 numMergedOcc 0
9 mol 236 unq 0 iso 0 dist 6.98151 11.2013 7.17676 13.3367 6.40312 8.35971 19.9815 13.6012 10.054 8.77254 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 9.88122 11.9794 6.91569 17.949 10.9761 6.57393 22.435 16.8927 10.8336 6.83152 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 9.94175 13.8985 5.38637 10.6346 6.20606 6.57393 9.0972 12.9258 13.477 9.75174 numMergedOcc 0
12 mol 238 unq 2 iso 0 dist 8.81534 5.33567 5.38637 6.24928 6.20606 6.57393 9.87348 12.9258 13.477 9.75174 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 9.53092 4.77548 7.48005 11.6963 5.79468 7.46176 18.2403 9.27954 14.8465 7.93997 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 8.44015 11.2529 9.0012 10.7818 5.12409 6.24356 10.9211 9.67417 10.0289 6.75305 numMergedOcc 0
15 mol 264 unq 1 iso 0 dist 6.21206 11.2529 9.5784 10.7818 9.67998 6.24356 10.9211 13.3898 10.0289 6.75305 numMergedOcc 0
16 mol 282 unq 0 iso 0 dist 9.20119 12.5533 6.85028 15.5242 6.3384 8.04483 18.3309 10.0733 9.63727 5.67266 numMergedOcc 0
17 mol 282 unq 1 iso 0 dist 9.20119 12.5533 6.85028 15.5242 6.3384 8.04483 20.2934 11.4393 9.60898 5.80981 numMergedOcc 0
18 mol 282 unq 2 iso 0 dist 9.20119 12.5533 6.85028 15.5242 6.3384 8.04483 8.64534 5.2527 4.85461 9.63346 numMergedOcc 0
19 mol 282 unq 3 iso 0 dist 9.20119 14.3567 7.32347 15.5242 6.3384 6.33524 18.3309 10.0733 5.04235 5.67266 numMergedOcc 0
20 mol 282 unq 4 iso 0 dist 9.20119 14.3567 7.32347 15.5242 6.3384 6.33524 20.2934 11.4393 8.37652 5.80981 numMergedOcc 0
21 mol 282 unq 5 iso 0 dist 9.20119 14.3567 7.32347 15.5242 6.3384 6.33524 8.64534 5.2527 8.85797 9.63346 numMergedOcc 0
22 mol 282 unq 6 iso 0 dist 8.96997 4.64783 6.85028 11.3408 6.3384 8.04483 14.0512 10.0733 9.63727 5.67266 numMergedOcc 0
23 mol 282 unq 7 iso 0 dist 8.96997 4.64783 6.85028 11.3408 6.3384 8.04483 12.6454 11.4393 9.60898 5.80981 numMergedOcc 0
24 mol 282 unq 8 iso 0 dist 8.96997 4.64783 6.85028 11.3408 6.3384 8.04483 4.30142 5.2527 4.85461 9.63346 numMergedOcc 0
25 mol 282 unq 9 iso 0 dist 8.96997 10.0286 7.32347 11.3408 6.3384 6.33524 14.0512 10.0733 5.04235 5.67266 numMergedOcc 0
26 mol 282 unq 10 iso 0 dist 8.96997 10.0286 7.32347 11.3408 6.3384 6.33524 12.6454 11.4393 8.37652 5.80981 numMergedOcc 0
27 mol 282 unq 11 iso 0 dist 8.96997 10.0286 7.32347 11.3408 6.3384 6.33524 4.30142 5.2527 8.85797 9.63346 numMergedOcc 0
