0 mol 18 unq 0 iso 0 dist 6.45965 8.95573 5.867 7.81434 4.70023 9.74802 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.20647 7.12852 9.73258 4.4349 5.51158 11.392 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 5.83051 7.12852 6.46914 4.4349 8.13182 11.392 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 7.81363 5.80964 4.4432 7.27358 8.30482 9.09071 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 6.15185 9.9443 8.44086 5.52173 8.98053 12.984 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 6.15185 9.9443 8.44086 8.49224 9.16879 11.7685 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.26722 4.95674 4.49984 9.59447 6.34149 10.3971 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.78 7.17226 4.49984 12.9102 6.34149 10.3971 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 5.84146 8.22824 8.72056 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.49649 8.80672 14.5276 5.84146 8.22824 12.9061 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.47476 9.55297 5.65619 5.41269 6.4822 5.83972 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.47476 7.447 14.1869 5.41269 6.4822 12.8106 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 8.47476 6.59782 8.66026 5.41269 6.4822 10.3472 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 8.22331 6.58245 4.40086 7.6839 8.05227 9.47487 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 6.32064 8.87757 7.23312 11.6765 9.70166 16.7645 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 7.55878 5.34745 5.3674 8.39255 7.09902 9.13657 numMergedOcc 0
16 mol 233 unq 1 iso 0 dist 7.55878 5.34745 5.3674 15.4291 8.73545 11.259 numMergedOcc 0
17 mol 233 unq 2 iso 0 dist 4.91191 7.99897 5.3674 6.69492 7.09902 9.13657 numMergedOcc 0
18 mol 233 unq 3 iso 0 dist 4.91191 7.99897 5.3674 5.36235 8.73545 11.259 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 6.00606 5.67249 5.99388 numMergedOcc 0
20 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 4.54692 7.6899 8.33529 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.58667 9.28545 13.5948 7.48053 5.83023 16.5306 numMergedOcc 0
