0 mol 17 unq 0 iso 0 dist 8.48453 5.21083 6.53817 11.263 8.25879 8.6745 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.80499 5.21083 9.81769 11.263 10.9688 8.6745 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.15042 6.12165 9.05728 9.4658 9.49478 6.34215 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 8.61163 12.4671 8.62669 11.8642 10.4432 8.79235 numMergedOcc 0
4 mol 53 unq 1 iso 0 dist 7.80805 8.86683 8.62669 12.6169 10.4432 8.79235 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 8.31551 9.66217 8.64208 16.0404 13.625 6.44825 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 7.80757 8.73 9.99029 11.1008 6.9648 9.71315 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.2835 11.9616 9.99029 11.4811 6.9648 9.71315 numMergedOcc 0
8 mol 78 unq 2 iso 0 dist 5.02591 8.07212 9.99029 8.06358 6.9648 9.71315 numMergedOcc 0
9 mol 108 unq 0 iso 0 dist 5.95326 6.46636 6.11003 10.5158 4.56766 8.97988 numMergedOcc 0
10 mol 144 unq 0 iso 0 dist 6.90626 6.38111 8.11591 10.4847 8.65006 9.08956 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 8.14907 10.7802 8.66709 11.7291 7.10286 5.55218 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.96824 13.2658 9.63295 12.496 5.93724 8.39573 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 8.3035 10.8341 9.4835 18.1704 13.9529 8.44407 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 8.3035 10.8341 9.4835 12.9113 8.52282 6.0155 numMergedOcc 0
15 mol 214 unq 2 iso 0 dist 8.3035 10.8341 9.4835 8.9694 8.48942 8.89981 numMergedOcc 0
16 mol 214 unq 3 iso 0 dist 9.01896 9.47512 9.4835 13.9749 13.9529 8.44407 numMergedOcc 0
17 mol 214 unq 4 iso 0 dist 9.01896 9.47512 9.4835 8.70011 8.52282 6.0155 numMergedOcc 0
18 mol 214 unq 5 iso 0 dist 9.01896 9.47512 9.4835 13.3862 8.48942 8.89981 numMergedOcc 0
19 mol 217 unq 0 iso 0 dist 9.55587 8.23649 5.10683 13.5948 4.64118 6.58871 numMergedOcc 0
20 mol 217 unq 1 iso 0 dist 9.38111 7.25518 5.10683 12.8408 4.64118 6.58871 numMergedOcc 0
21 mol 217 unq 2 iso 0 dist 8.28941 6.94126 5.10683 5.01648 4.64118 6.58871 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 5.52981 6.43128 9.88212 5.92364 6.04002 7.9987 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.96424 4.36623 7.30244 12.0096 14.9028 8.63649 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 5.40366 4.36623 7.29796 12.0096 14.1071 8.63649 numMergedOcc 0
25 mol 224 unq 0 iso 0 dist 7.69537 9.41461 7.04127 10.9012 5.13732 5.36326 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.27588 11.574 7.72749 12.4659 4.74189 4.93584 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 8.27977 8.89193 5.17586 12.9378 8.4236 7.03656 numMergedOcc 0
