0 mol 15 unq 0 iso 0 dist 6.82187 4.96682 9.29358 12.4204 8.4014 11.1793 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.0319 9.97498 9.75144 4.19221 7.49157 6.72423 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.0319 9.97498 9.75144 6.17633 7.73794 4.0664 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.80897 11.1917 6.73162 4.28862 7.98005 8.62111 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.80897 11.1917 6.73162 4.93643 8.31381 9.18438 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 8.37225 6.0365 6.73162 5.34503 7.98005 8.62111 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 8.37225 6.0365 6.73162 4.74002 8.31381 9.18438 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 8.03754 10.1053 9.83618 3.83842 9.02471 10.4465 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 8.4143 7.14908 9.02278 3.63735 6.62699 7.82564 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.0139 13.7384 7.87814 4.15002 5.25027 9.64347 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 8.0139 13.7384 7.87814 9.36535 4.37025 4.39784 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 7.11695 6.85223 8.36431 4.56304 8.85601 11.3487 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 9.32858 5.13173 7.20326 5.24084 7.78789 6.69019 numMergedOcc 0
13 mol 117 unq 1 iso 0 dist 9.32858 5.13173 7.20326 9.30266 7.42146 4.18875 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 9.89053 5.24695 6.63981 10.6832 6.80627 5.87751 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 9.88662 10.9183 8.33261 10.0388 6.73617 6.60281 numMergedOcc 0
16 mol 147 unq 1 iso 0 dist 9.88662 10.9183 8.33261 9.71714 9.03544 9.65163 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 8.41774 10.8622 9.13561 15.2106 9.00072 11.2183 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 9.63185 6.70227 8.96511 11.1931 4.72821 8.86443 numMergedOcc 0
19 mol 241 unq 0 iso 0 dist 7.73213 6.83816 6.83797 9.91137 7.52531 7.5936 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 4.81916 6.20663 9.41725 9.21484 4.9764 13.6468 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 4.81916 6.20663 9.41725 10.3506 6.36559 13.3297 numMergedOcc 0
