0 mol 41 unq 0 iso 0 dist 8.91418 11.3802 9.22814 9.00425 7.29079 4.98483 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 6.0961 15.2353 9.22814 12.6048 7.29079 4.98483 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 5.67098 4.92918 9.11019 6.24306 9.35784 10.3259 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 8.58218 3.98878 9.11019 9.63592 9.35784 10.3259 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.09641 4.73715 9.15766 7.69571 9.92638 3.7066 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 5.44714 10.6782 9.20053 3.97791 5.29949 10.4539 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.73897 5.9683 8.03691 3.75291 8.50705 4.85121 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 7.50392 4.90139 9.77059 5.68679 7.29911 10.5172 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 7.65559 11.9416 8.8048 3.72135 6.65272 8.69327 numMergedOcc 0
9 mol 162 unq 1 iso 0 dist 7.65559 11.9416 8.8048 7.66483 9.66989 6.65154 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 9.56248 5.02687 9.71921 15.8873 8.62366 16.2049 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 9.56248 5.02687 9.71921 14.9274 9.44973 13.6231 numMergedOcc 0
12 mol 173 unq 2 iso 0 dist 9.56248 5.02687 9.71921 9.35913 6.52508 9.96192 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 9.00025 4.95003 7.92974 4.6563 9.65629 5.61641 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 8.32685 13.1844 8.4273 15.7632 9.27218 6.57766 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 6.74777 14.3934 8.4273 15.6628 9.27218 6.57766 numMergedOcc 0
16 mol 197 unq 2 iso 0 dist 9.62514 17.4892 8.4273 18.7224 9.27218 6.57766 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 9.42374 12.1148 6.35305 9.69119 5.3819 7.35194 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 9.42374 11.6178 9.23348 9.69119 5.3819 5.87202 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 7.83363 7.87406 7.6416 4.98419 8.24424 9.94684 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 7.83363 7.87406 7.6416 7.08719 7.0942 8.78951 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 7.83363 7.87406 7.6416 10.7478 6.01775 12.6141 numMergedOcc 0
