0 mol 25 unq 0 iso 0 dist 9.80157 6.7276 8.23292 13.3161 16.5953 8.6396 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.29561 12.429 6.85305 17.958 11.042 7.10899 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 9.67476 13.4853 8.64208 21.17 13.1954 8.65898 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 5.04007 5.82571 6.87176 8.25884 5.00567 8.04256 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 5.04007 5.82571 6.87176 13.0992 12.5342 7.51075 numMergedOcc 0
5 mol 68 unq 2 iso 0 dist 7.81025 5.4779 6.87176 11.0943 5.00567 8.04256 numMergedOcc 0
6 mol 68 unq 3 iso 0 dist 7.81025 5.4779 6.87176 10.7546 12.5342 7.51075 numMergedOcc 0
7 mol 68 unq 4 iso 0 dist 6.60395 5.82571 5.57389 8.25884 5.33771 8.04256 numMergedOcc 0
8 mol 68 unq 5 iso 0 dist 6.60395 5.82571 5.57389 13.0992 9.21957 7.51075 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.08674 9.08836 4.83274 9.0101 4.00834 6.4551 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.33694 9.08836 7.89214 9.0101 9.6911 6.4551 numMergedOcc 0
11 mol 83 unq 0 iso 0 dist 5.41154 6.61257 7.77558 11.7158 11.9566 9.21173 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 7.88346 12.628 7.5984 14.547 11.7934 8.30654 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 4.85278 9.63894 8.70197 8.91036 4.52935 8.1088 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 6.73513 10.4602 6.57849 9.67866 7.47443 8.10287 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 8.53152 5.19318 7.87125 7.67675 10.1355 5.87223 numMergedOcc 0
16 mol 212 unq 1 iso 0 dist 8.53152 5.19318 7.87125 12.2251 7.5418 8.062 numMergedOcc 0
17 mol 212 unq 2 iso 0 dist 8.53152 5.19318 7.87125 12.1291 11.1789 8.70011 numMergedOcc 0
18 mol 229 unq 0 iso 0 dist 5.95601 6.23286 8.0007 8.17234 5.17118 5.57702 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 7.73969 5.81354 6.73134 5.40329 6.0905 9.05929 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 9.82576 6.14115 6.40592 10.3393 4.84498 8.40773 numMergedOcc 0
21 mol 241 unq 1 iso 0 dist 9.82576 6.14115 6.40592 14.6341 6.70277 9.18476 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.98041 6.00315 6.96379 12.6191 5.73217 8.06771 numMergedOcc 0
