0 mol 7 unq 0 iso 0 dist 9.19844 6.11915 6.04832 8.02892 5.82034 6.14469 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 9.80852 8.27744 5.64906 6.60096 8.85817 7.92012 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 9.51411 6.92283 5.64906 10.9223 8.85817 7.92012 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.98634 6.62574 6.71313 14.5465 13.3903 8.29857 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 8.07681 6.98858 6.54699 14.5966 13.2873 8.19993 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.84829 12.1056 9.81484 11.7281 6.60364 6.77241 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 5.84829 9.18589 5.77527 11.7281 6.60364 5.50508 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 9.87183 6.70394 8.91675 13.0487 10.0785 7.32087 numMergedOcc 0
8 mol 194 unq 0 iso 0 dist 8.65631 6.38935 5.67863 10.896 9.82808 6.38324 numMergedOcc 0
9 mol 194 unq 1 iso 0 dist 8.65631 14.6792 9.42308 10.896 9.82808 6.1886 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 5.36495 6.18998 5.3481 12.6417 11.5344 6.94789 numMergedOcc 0
11 mol 244 unq 0 iso 0 dist 7.76796 14.2967 6.61951 11.642 5.01275 6.22122 numMergedOcc 0
12 mol 256 unq 0 iso 0 dist 6.5266 10.7996 6.65749 10.8564 4.51747 4.98734 numMergedOcc 0
13 mol 256 unq 1 iso 0 dist 6.5266 10.7996 6.65749 7.40057 4.74632 6.33496 numMergedOcc 0
14 mol 256 unq 2 iso 0 dist 6.5266 6.82173 4.73652 10.8564 4.51747 6.37963 numMergedOcc 0
15 mol 256 unq 3 iso 0 dist 6.5266 6.82173 4.73652 7.40057 4.74632 6.00636 numMergedOcc 0
16 mol 273 unq 0 iso 0 dist 7.14243 5.62662 6.83684 10.6456 5.91142 7.16346 numMergedOcc 0
