0 mol 54 unq 0 iso 0 dist 8.34361 12.1383 4.54428 13.2619 6.54183 7.4971 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 9.91313 5.78708 9.65026 7.49081 9.70415 7.15161 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.40355 7.21958 8.24753 10.1498 8.41567 5.49132 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 6.40355 7.21958 8.24753 4.57694 5.56964 6.71804 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.04448 8.19607 7.80347 8.91618 6.78839 12.3572 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.04448 8.19607 7.80347 14.8024 8.02354 11.0641 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 8.85708 8.6257 9.14994 4.60144 8.81172 8.12649 numMergedOcc 0
7 mol 172 unq 0 iso 0 dist 9.41172 5.71709 5.86619 4.70355 7.34586 5.82308 numMergedOcc 0
8 mol 172 unq 1 iso 0 dist 8.2809 5.71709 8.4615 8.26604 9.54849 11.5945 numMergedOcc 0
9 mol 172 unq 2 iso 0 dist 8.2809 5.71709 8.4615 4.70355 5.5139 5.82308 numMergedOcc 0
10 mol 185 unq 0 iso 0 dist 7.18997 8.51 8.21075 6.98598 9.87065 14.7264 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 9.39697 7.28107 9.18725 8.95444 8.3705 6.94759 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 7.43427 5.52817 7.71876 5.53181 4.851 9.16568 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 7.50841 11.414 7.71876 5.02331 4.851 9.16568 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.87224 9.61496 9.01934 9.86326 6.83046 7.02319 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 7.30582 9.21526 9.86427 11.3529 8.98668 10.0597 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 8.52434 12.204 9.67318 5.45802 7.63152 14.937 numMergedOcc 0
17 mol 250 unq 1 iso 0 dist 8.63767 15.9078 9.67318 3.78208 7.63152 14.937 numMergedOcc 0
