0 mol 7 unq 0 iso 0 dist 7.10621 9.36807 10.515 13.8829 8.72114 9.97624 5.44992 5.72491 7.45262 10.1959 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 9.36807 10.515 13.8829 8.72114 9.97624 4.74523 9.67579 6.96586 13.9514 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 9.5997 9.62394 9.57198 3.98483 9.78006 8.04924 7.28672 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.86465 8.63333 6.47744 10.2049 8.80614 9.11258 6.89191 10.5365 7.93481 13.9844 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.35756 8.89374 6.47744 5.49591 8.80614 9.11258 11.0355 10.5365 7.93481 13.9844 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 7.4729 5.81965 6.99832 9.50382 6.95572 5.39745 5.7134 12.3604 9.28578 12.1199 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.82344 9.70512 6.99832 7.56363 6.95572 5.39745 10.7874 12.3604 9.28578 12.1199 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.11802 7.92688 4.68409 5.92062 9.22661 6.51868 8.6769 12.2715 9.4062 4.35684 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.11802 7.92688 4.68409 6.61891 7.56378 7.34698 8.6769 12.2715 9.4062 11.668 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 7.63312 7.98142 9.60512 5.63555 5.9176 5.97685 9.92777 11.6558 5.49808 6.12563 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 7.63312 7.37327 13.3389 5.63555 5.9176 8.9289 9.92777 11.6558 7.96291 6.12563 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 5.59424 8.36822 5.71262 8.49529 8.77999 7.33225 7.0057 7.24199 8.53433 3.86183 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 10.9607 5.41321 7.57454 10.5813 8.03442 7.1372 4.59123 numMergedOcc 0
13 mol 227 unq 1 iso 0 dist 8.65997 6.95902 6.43754 9.72615 5.41321 7.57454 7.22396 8.03442 7.1372 4.59123 numMergedOcc 0
14 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 8.81835 7.98231 8.71497 5.60748 10.5803 6.39918 6.31909 numMergedOcc 0
15 mol 259 unq 1 iso 0 dist 7.46176 7.48005 5.79468 8.81835 7.08526 8.71497 5.60748 8.55558 6.39918 6.31909 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 6.24356 9.5784 9.67998 7.52936 5.93616 7.34094 8.45726 11.0622 6.5422 6.67381 numMergedOcc 0
