0 mol 7 unq 0 iso 0 dist 9.02869 13.9246 9.49373 5.83658 5.37308 8.23909 10.826 12.421 13.823 9.60499 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.69637 5.06937 9.34846 10.4452 6.85527 9.90845 9.20254 12.0295 9.59761 8.86116 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.69637 5.06937 9.34846 10.4452 6.85527 9.90845 12.3729 13.7153 9.89489 8.38394 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 8.80824 5.14617 6.42762 6.09472 6.80053 6.86946 5.74878 9.70616 5.889 4.99221 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.84762 5.81849 9.53895 13.8593 8.82375 9.42766 17.0883 13.0414 14.0677 8.73993 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 5.2184 5.7998 9.53895 10.2589 8.82375 9.42766 13.7656 13.0414 14.0677 8.73993 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.79195 7.72261 6.00667 12.3165 6.55423 9.48243 18.5054 13.8341 11.6637 9.91388 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 9.2759 15.0617 6.00667 10.1412 6.55423 9.48243 19.8715 13.8341 11.6637 9.91388 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 8.76088 13.0543 6.00667 11.5517 6.55423 9.48243 19.3263 13.8341 11.6637 9.91388 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 7.03107 4.44885 5.25888 6.6776 4.51101 5.08206 13.7028 13.3338 12.1783 9.0018 numMergedOcc 0
10 mol 175 unq 1 iso 0 dist 7.03107 4.44885 5.25888 6.6776 4.51101 5.08206 10.4662 8.84385 7.28617 5.6234 numMergedOcc 0
11 mol 175 unq 2 iso 0 dist 7.03107 4.44885 5.25888 6.6776 4.51101 5.08206 7.42609 9.81041 5.77256 6.57069 numMergedOcc 0
12 mol 175 unq 3 iso 0 dist 7.30813 4.81365 5.25888 9.09725 4.51101 5.08206 16.8008 13.3338 12.1783 9.0018 numMergedOcc 0
13 mol 175 unq 4 iso 0 dist 7.30813 4.81365 5.25888 9.09725 4.51101 5.08206 12.0877 8.84385 7.28617 5.6234 numMergedOcc 0
14 mol 175 unq 5 iso 0 dist 7.30813 4.81365 5.25888 9.09725 4.51101 5.08206 9.79219 9.81041 5.77256 6.57069 numMergedOcc 0
15 mol 182 unq 0 iso 0 dist 8.27913 4.39505 8.63031 9.36307 8.27268 7.86625 9.72559 10.8493 5.40949 9.31746 numMergedOcc 0
16 mol 182 unq 1 iso 0 dist 8.85111 11.2827 8.63031 15.8237 8.27268 7.86625 13.9897 10.8493 5.40949 9.31746 numMergedOcc 0
17 mol 182 unq 2 iso 0 dist 6.38335 13.728 8.63031 12.9992 8.27268 7.86625 16.9963 10.8493 5.40949 9.31746 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 5.25149 6.555 7.81237 15.0279 13.3213 9.8711 6.19375 5.39218 4.90657 9.23153 numMergedOcc 0
19 mol 229 unq 0 iso 0 dist 8.4208 10.4845 7.32814 10.3466 5.88282 9.84492 11.0325 12.1268 11.9226 8.22528 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 8.88741 6.13416 8.69675 7.15785 6.43209 9.62828 6.5875 7.30472 10.5691 8.02547 numMergedOcc 0
