0 mol 1 unq 0 iso 0 dist 9.60596 15.4778 8.31812 15.5095 7.73435 3.41028 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.60596 15.4778 8.31812 9.93683 5.71995 6.04733 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 5.78238 6.4301 5.47982 13.3639 9.38831 7.43716 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.99116 5.88204 7.62728 5.32605 8.58543 10.1989 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.99116 5.88204 7.62728 7.129 8.99433 5.35465 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 7.95383 7.30833 7.62728 5.9876 8.58543 10.1989 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 7.95383 7.30833 7.62728 3.69759 8.99433 5.35465 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.53053 8.00142 8.40501 12.3077 8.48184 15.2357 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 9.53053 8.00142 8.40501 12.4732 9.01011 12.4203 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 9.53053 6.05557 9.82156 12.3077 8.48184 9.24742 numMergedOcc 0
10 mol 92 unq 3 iso 0 dist 9.53053 6.05557 9.82156 12.4732 9.01011 13.1109 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 9.975 11.5208 9.32166 6.74001 7.63127 4.80028 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 9.975 9.01154 5.92729 6.74001 7.63127 4.68752 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 7.11599 11.1953 7.75632 10.6794 7.82546 5.76368 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 5.65801 9.32421 9.27871 12.4916 9.29264 16.145 numMergedOcc 0
15 mol 173 unq 1 iso 0 dist 8.58733 6.71137 9.27871 15.5944 9.29264 16.145 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 5.32236 11.1811 6.59925 11.9192 7.32419 3.87881 numMergedOcc 0
17 mol 175 unq 1 iso 0 dist 5.32236 11.1811 6.59925 11.0956 8.31961 9.0465 numMergedOcc 0
18 mol 176 unq 0 iso 0 dist 8.20587 12.2751 8.40904 8.00182 8.5865 5.59964 numMergedOcc 0
19 mol 176 unq 1 iso 0 dist 7.67133 10.9063 8.40904 11.4235 8.5865 5.59964 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 9.13708 15.6006 7.39369 11.1809 5.52678 6.2135 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 9.13708 15.6006 7.39369 7.62027 9.81666 13.7 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 5.05201 4.97404 7.14633 11.6645 9.56257 13.4732 numMergedOcc 0
23 mol 227 unq 1 iso 0 dist 5.05201 13.9288 9.94302 11.6645 9.56257 6.30626 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 6.88874 8.24007 8.62955 7.37634 8.55481 7.10224 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 9.0112 5.22299 5.49079 9.26335 7.97588 4.98629 numMergedOcc 0
