0 mol 29 unq 0 iso 0 dist 8.69877 12.5175 7.08841 9.09595 5.34723 3.44035 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.11019 10.3259 9.35784 6.24599 5.42296 7.63211 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.15766 3.7066 9.92638 4.91335 9.40835 8.56187 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.17967 4.0291 6.52939 4.13187 9.11491 5.9297 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.20053 10.4539 5.29949 14.5375 5.45882 8.39067 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 9.20053 10.4539 5.29949 13.2977 4.57487 7.44033 numMergedOcc 0
6 mol 175 unq 0 iso 0 dist 7.92974 5.61641 9.65629 7.09629 7.6077 5.42718 numMergedOcc 0
7 mol 197 unq 0 iso 0 dist 8.4273 6.57766 9.27218 7.35883 9.6071 13.3283 numMergedOcc 0
8 mol 197 unq 1 iso 0 dist 8.4273 6.57766 9.27218 14.0686 9.77656 17.435 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 6.35305 7.35194 5.3819 6.42785 4.51124 5.80328 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 6.35305 7.35194 5.3819 10.9716 8.41517 3.68217 numMergedOcc 0
11 mol 204 unq 2 iso 0 dist 9.23348 5.87202 5.3819 7.66776 4.51124 5.80328 numMergedOcc 0
12 mol 204 unq 3 iso 0 dist 9.23348 5.87202 5.3819 8.03926 8.41517 3.68217 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 9.56792 5.83492 8.65196 6.05616 6.8984 6.12056 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 8.7572 6.83312 8.91356 11.09 9.27079 14.9585 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 8.7572 4.47561 9.57455 11.09 9.27079 7.82941 numMergedOcc 0
16 mol 237 unq 0 iso 0 dist 6.56421 5.08738 7.12731 10.1524 8.33629 5.88058 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 5.85173 7.3298 8.5613 4.03195 5.30187 10.6938 numMergedOcc 0
