0 mol 59 unq 0 iso 0 dist 6.85083 7.35881 7.17396 10.7972 6.34264 6.48625 5.73075 7.31539 6.56212 11.1377 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 5.89394 6.80709 7.4729 14.7682 11.8037 9.514 8.3435 4.46885 8.3773 12.7532 numMergedOcc 0
2 mol 117 unq 0 iso 0 dist 9.41387 9.3855 7.90328 13.3052 10.4589 9.85576 15.361 7.20875 8.84018 12.4378 numMergedOcc 0
3 mol 127 unq 0 iso 0 dist 9.79448 6.02237 9.30299 6.46753 9.75166 8.40046 11.9156 12.8087 6.08673 12.1959 numMergedOcc 0
4 mol 178 unq 0 iso 0 dist 6.01118 9.73148 6.69288 11.0304 12.2822 8.0974 8.62441 8.44333 9.11204 9.80877 numMergedOcc 0
5 mol 182 unq 0 iso 0 dist 6.31492 7.48422 9.31746 5.16184 5.40949 7.86625 9.79987 8.82964 9.56028 4.82437 numMergedOcc 0
6 mol 182 unq 1 iso 0 dist 7.8621 6.98787 9.31746 8.54162 5.40949 7.86625 8.35727 8.82964 9.56028 4.82437 numMergedOcc 0
7 mol 224 unq 0 iso 0 dist 7.69537 5.41675 6.61986 13.2281 6.46679 9.75313 10.9012 5.13732 8.08349 3.56689 numMergedOcc 0
8 mol 224 unq 1 iso 0 dist 7.69537 5.41675 6.61986 7.73616 7.85135 6.08709 10.9012 5.13732 8.08349 11.4272 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 9.2521 10.1821 7.31233 11.5665 12.1448 5.24313 17.3504 10.3162 9.12776 12.4194 numMergedOcc 0
10 mol 259 unq 0 iso 0 dist 6.49599 14.1932 8.13497 10.3275 5.71237 6.77279 14.6176 8.8603 9.07743 9.90573 numMergedOcc 0
11 mol 259 unq 1 iso 0 dist 6.49599 13.8605 7.88519 10.3275 5.71237 9.58006 8.96256 7.20604 9.63573 12.7528 numMergedOcc 0
12 mol 259 unq 2 iso 0 dist 6.49599 13.8605 7.88519 10.3275 5.71237 9.58006 14.6176 8.8603 7.66153 9.90573 numMergedOcc 0
13 mol 259 unq 3 iso 0 dist 9.34738 13.8605 7.84554 10.3275 9.10984 9.58006 8.96256 5.05362 9.63573 12.7528 numMergedOcc 0
14 mol 259 unq 4 iso 0 dist 9.34738 13.8605 7.84554 10.3275 9.10984 9.58006 14.6176 5.8801 7.66153 9.90573 numMergedOcc 0
15 mol 259 unq 5 iso 0 dist 9.47382 13.8605 7.46176 10.3275 11.8501 9.58006 8.96256 5.21606 9.63573 12.7528 numMergedOcc 0
16 mol 259 unq 6 iso 0 dist 9.47382 13.8605 7.46176 10.3275 11.8501 9.58006 14.6176 11.8896 7.66153 9.90573 numMergedOcc 0
17 mol 276 unq 0 iso 0 dist 7.11272 5.75852 6.87396 13.5901 8.86096 9.05218 12.8457 8.26321 8.6759 5.58312 numMergedOcc 0
