0 mol 16 unq 0 iso 0 dist 9.51574 9.39137 6.9912 5.58451 6.29703 10.2336 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 6.87293 9.90177 6.50117 6.89206 7.38759 13.2719 numMergedOcc 0
2 mol 108 unq 0 iso 0 dist 7.84262 9.29208 6.45014 12.0135 7.29462 5.4057 numMergedOcc 0
3 mol 108 unq 1 iso 0 dist 9.29208 7.84262 6.45014 12.0135 5.4057 7.29462 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.40633 9.42432 7.00041 6.83988 6.49205 11.3751 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 9.40633 9.22776 11.553 6.83988 6.49205 13.3876 numMergedOcc 0
6 mol 178 unq 0 iso 0 dist 7.69328 5.71438 5.82281 15.6558 8.0974 12.1615 numMergedOcc 0
7 mol 224 unq 0 iso 0 dist 5.90784 8.50322 10.9885 5.41021 6.56437 9.53131 numMergedOcc 0
8 mol 224 unq 1 iso 0 dist 8.50322 5.90784 10.9885 5.41021 9.53131 6.56437 numMergedOcc 0
9 mol 257 unq 0 iso 0 dist 6.75578 9.29499 5.42367 10.0383 4.97263 9.76945 numMergedOcc 0
10 mol 257 unq 1 iso 0 dist 6.75578 9.29499 5.42367 5.86413 5.36776 9.82638 numMergedOcc 0
11 mol 259 unq 0 iso 0 dist 6.13752 9.29355 11.4197 6.59107 6.77279 10.3594 numMergedOcc 0
12 mol 259 unq 1 iso 0 dist 6.13752 9.29355 11.4197 11.1778 9.58006 13.8212 numMergedOcc 0
13 mol 259 unq 2 iso 0 dist 6.13752 7.87978 12.0037 6.59107 6.77279 11.5101 numMergedOcc 0
14 mol 259 unq 3 iso 0 dist 6.13752 7.87978 12.0037 11.1778 9.58006 15.8133 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 7.70185 7.97117 6.80715 11.2887 7.89852 9.96963 numMergedOcc 0
16 mol 273 unq 1 iso 0 dist 7.97117 7.70185 6.80715 13.4309 8.90885 10.8195 numMergedOcc 0
17 mol 273 unq 2 iso 0 dist 7.97117 7.70185 6.80715 11.2887 9.96963 7.89852 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.77593 8.85972 8.52622 10.2086 8.13489 14.8587 numMergedOcc 0
