0 mol 48 unq 0 iso 0 dist 6.04551 4.92775 7.87476 6.8073 6.62574 5.89173 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 8.28883 5.29743 7.37491 8.68989 3.95005 8.40186 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 6.01454 15.1442 9.77004 15.4386 9.78936 9.42099 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 6.01454 4.89976 8.36323 6.42242 6.98858 5.72703 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 7.37989 13.8604 9.55089 22.6107 17.7193 8.99451 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 8.63522 6.04036 9.49592 9.2062 6.69798 6.07633 numMergedOcc 0
6 mol 102 unq 1 iso 0 dist 5.43401 6.04036 5.88034 9.2062 5.6591 6.07633 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.56593 9.65579 7.53168 8.71007 4.8653 6.90583 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 8.56593 5.93647 5.18805 8.71007 4.8653 6.75593 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 8.56593 8.51016 7.11158 8.71007 4.8653 8.83562 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 9.45847 4.75805 8.98606 4.88303 13.3059 5.12964 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 9.89311 12.3846 9.88692 18.1751 13.3601 6.81516 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 7.76477 10.0206 9.69133 12.1646 5.39184 9.78273 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 6.82688 11.775 9.69133 8.27761 5.39184 9.78273 numMergedOcc 0
14 mol 232 unq 2 iso 0 dist 5.92175 6.89215 9.69133 9.78197 5.39184 9.78273 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 6.18866 10.441 9.38713 15.2599 10.4369 8.76518 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 8.18086 8.32095 8.54286 16.5357 12.1185 9.25035 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 8.57305 9.52365 9.30975 14.7385 8.01004 9.36974 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 8.61786 6.09382 9.92035 9.54381 5.4894 9.32971 numMergedOcc 0
19 mol 268 unq 0 iso 0 dist 6.74419 9.62272 8.69312 7.40731 5.28541 9.6128 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 6.23539 13.6904 9.48076 10.7239 5.10104 6.23115 numMergedOcc 0
