0 mol 34 unq 0 iso 0 dist 9.76059 11.439 9.47087 3.69256 8.4441 12.3879 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 8.8197 14.9643 9.47087 3.63648 8.4441 12.3879 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 6.65821 4.87451 9.49441 3.96491 8.61124 6.15909 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 8.20634 11.0026 9.24433 8.04056 7.30467 4.41154 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.11013 4.82573 8.17967 8.47393 9.11491 4.13187 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 6.32393 12.2186 9.20053 7.68828 5.45882 14.5375 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 6.32393 12.2186 9.20053 8.44413 4.57487 13.2977 numMergedOcc 0
7 mol 193 unq 0 iso 0 dist 9.06161 3.79373 9.53066 5.57164 6.17074 4.8988 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 8.80672 13.0354 6.35305 6.82158 4.51124 6.42785 numMergedOcc 0
9 mol 204 unq 1 iso 0 dist 8.80672 13.0354 6.35305 11.8793 8.41517 10.9716 numMergedOcc 0
10 mol 204 unq 2 iso 0 dist 8.80672 13.9605 9.23348 6.82158 4.51124 7.66776 numMergedOcc 0
11 mol 204 unq 3 iso 0 dist 8.80672 13.9605 9.23348 11.8793 8.41517 8.03926 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 7.21089 13.3941 8.7572 5.70307 9.27079 11.09 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 5.75996 13.1998 9.84931 3.65952 5.50017 10.7337 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 7.44932 16.5178 9.84931 7.05149 5.50017 10.7337 numMergedOcc 0
15 mol 250 unq 0 iso 0 dist 9.7235 7.50703 9.45903 5.12318 8.73744 7.35853 numMergedOcc 0
