0 mol 54 unq 0 iso 0 dist 9.20429 8.73588 4.02037 12.9186 7.16132 10.1596 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 9.40333 7.50377 7.50975 12.6908 9.8703 10.0169 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.46657 6.55112 5.31985 6.38237 6.72869 9.59729 numMergedOcc 0
3 mol 105 unq 0 iso 0 dist 9.94398 9.15226 4.4598 4.59356 9.16718 9.17843 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 7.9258 7.84768 4.48636 6.27754 6.24825 9.0534 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 7.69229 9.65468 5.65603 6.69138 7.37333 9.43904 numMergedOcc 0
6 mol 162 unq 1 iso 0 dist 7.69229 9.65468 5.65603 6.82744 7.45998 7.01095 numMergedOcc 0
7 mol 195 unq 0 iso 0 dist 7.04524 9.20541 6.04871 6.61895 9.03441 11.3524 numMergedOcc 0
8 mol 195 unq 1 iso 0 dist 7.04524 6.65077 8.04534 6.61895 9.03441 12.8025 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 6.23932 9.79826 8.97813 9.99561 6.49765 5.03818 numMergedOcc 0
10 mol 217 unq 0 iso 0 dist 6.23025 7.00456 5.60586 4.76575 7.60269 10.3247 numMergedOcc 0
11 mol 217 unq 1 iso 0 dist 6.23025 8.99484 4.64118 4.76575 7.60269 9.37602 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 8.27093 9.34023 4.664 5.92282 5.23634 8.85955 numMergedOcc 0
13 mol 227 unq 1 iso 0 dist 8.27093 5.77762 4.1511 5.92282 5.23634 6.09335 numMergedOcc 0
14 mol 227 unq 2 iso 0 dist 9.02226 9.34023 8.49509 5.92282 6.91318 8.85955 numMergedOcc 0
15 mol 227 unq 3 iso 0 dist 9.02226 5.77762 4.69247 5.92282 6.91318 6.09335 numMergedOcc 0
16 mol 267 unq 0 iso 0 dist 9.44648 9.58438 9.72229 14.5438 8.8293 18.3434 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 4.81916 6.42951 3.97543 9.31926 9.35539 13.0595 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 4.81916 6.42951 3.97543 13.1828 8.9682 7.16209 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 4.81916 6.42951 3.97543 10.6994 6.92711 4.62936 numMergedOcc 0
