0 mol 26 unq 0 iso 0 dist 8.44506 7.98005 12.4814 7.11305 6.38243 8.97754 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 7.57959 7.68478 8.44315 10.0309 15.4539 8.50003 numMergedOcc 0
2 mol 38 unq 1 iso 0 dist 7.57959 7.68478 8.44315 10.622 14.8247 7.00717 numMergedOcc 0
3 mol 38 unq 2 iso 0 dist 7.05737 7.68478 4.841 10.0309 11.9816 8.50003 numMergedOcc 0
4 mol 38 unq 3 iso 0 dist 7.05737 7.68478 4.841 10.622 10.3877 7.00717 numMergedOcc 0
5 mol 38 unq 4 iso 0 dist 7.54179 6.87122 4.841 6.37474 11.9816 8.50003 numMergedOcc 0
6 mol 38 unq 5 iso 0 dist 7.54179 6.87122 4.841 6.10572 10.3877 7.00717 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 7.27383 6.79356 6.21346 4.00553 6.87028 9.10675 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 7.9814 8.06267 9.21465 5.74372 9.45329 9.63906 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 7.9814 5.88334 6.22999 5.74372 9.45329 7.71872 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 8.85586 7.37171 12.6176 6.41115 9.28577 4.27766 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 5.16364 8.62079 12.6176 5.9144 9.28577 4.27766 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 7.11 7.37171 14.2305 6.41115 11.9068 4.27766 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 6.43433 6.87434 4.25001 6.95317 4.99604 5.92828 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 6.43433 6.87434 4.25001 7.57713 10.2181 9.1247 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 6.98934 7.60162 9.53672 10.5082 11.6545 4.55071 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 7.99623 7.60162 8.90156 10.5082 12.3083 4.55071 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 5.49226 8.39897 7.88487 8.57851 12.0154 7.7464 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 5.49226 8.39897 7.88487 10.5361 12.2104 5.12272 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 8.35555 6.79114 4.78989 4.94983 7.1069 8.60651 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.24795 5.90765 9.28201 3.90244 8.57801 8.92135 numMergedOcc 0
21 mol 194 unq 0 iso 0 dist 6.26839 9.52922 7.82899 10.0756 5.53324 4.45769 numMergedOcc 0
22 mol 194 unq 1 iso 0 dist 6.26839 9.52922 7.82899 16.4082 11.4466 8.99961 numMergedOcc 0
23 mol 253 unq 0 iso 0 dist 9.66465 8.94786 3.15936 10.1605 12.4623 9.454 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 7.71657 8.97531 5.48178 4.74189 8.20485 9.83672 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 7.67245 5.35705 5.78276 10.0918 7.59696 7.56691 numMergedOcc 0
26 mol 278 unq 1 iso 0 dist 9.12395 6.64378 5.78276 6.48173 7.59696 7.56691 numMergedOcc 0
