0 mol 11 unq 0 iso 0 dist 8.22232 4.92274 5.27564 11.2611 5.11518 6.56599 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 8.34508 5.49127 5.27564 10.0564 5.19841 6.35021 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.65828 5.02457 9.00844 9.03539 13.4501 7.24149 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.65828 5.02457 9.00844 13.053 10.8459 8.63881 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.46741 6.28596 5.96987 9.01832 10.0453 9.47087 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.0757 9.10389 6.43837 12.5473 4.95855 9.74531 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 9.8958 9.74441 6.43837 11.5803 4.95855 9.74531 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 7.97386 6.6296 8.80762 11.6454 5.21732 9.36265 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 8.3814 12.0696 8.80762 13.0155 5.21732 9.36265 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 5.45684 11.7446 7.32896 15.239 10.2974 7.77991 numMergedOcc 0
10 mol 64 unq 1 iso 0 dist 5.45684 11.7446 7.32896 10.4215 4.97497 5.1488 numMergedOcc 0
11 mol 64 unq 2 iso 0 dist 7.76644 12.8925 7.32896 17.8231 10.2974 7.77991 numMergedOcc 0
12 mol 64 unq 3 iso 0 dist 7.76644 12.8925 7.32896 11.8445 4.97497 5.1488 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 6.45169 4.71928 6.27699 6.66749 6.66108 9.50228 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 6.55445 7.96698 9.96787 15.6295 13.6989 9.08475 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.58817 6.98313 9.66153 11.3352 11.4449 9.23089 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.55294 11.4557 8.10034 16.6149 14.994 7.82212 numMergedOcc 0
17 mol 199 unq 0 iso 0 dist 8.255 4.97431 6.93031 10.4262 5.19058 8.24056 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 8.59787 17.388 9.85636 19.5076 10.9274 6.35305 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 8.50367 16.8752 9.80817 17.2492 9.86026 7.40646 numMergedOcc 0
20 mol 210 unq 1 iso 0 dist 8.50367 16.8752 9.80817 17.8346 9.37812 6.2024 numMergedOcc 0
21 mol 210 unq 2 iso 0 dist 8.94889 18.0897 9.80817 15.1404 9.86026 7.40646 numMergedOcc 0
22 mol 210 unq 3 iso 0 dist 8.94889 18.0897 9.80817 16.6916 9.37812 6.2024 numMergedOcc 0
23 mol 228 unq 0 iso 0 dist 9.63694 5.44117 8.44525 7.39392 5.09026 6.66395 numMergedOcc 0
24 mol 228 unq 1 iso 0 dist 9.64659 5.21826 8.17701 7.56863 5.19012 6.51052 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 6.51248 12.9014 8.99154 16.5489 10.0623 9.96388 numMergedOcc 0
