0 mol 78 unq 0 iso 0 dist 6.53252 4.9102 6.13394 10.16 3.63624 9.2057 numMergedOcc 0
1 mol 158 unq 0 iso 0 dist 8.57243 9.97778 9.98554 13.4942 7.59334 7.97228 numMergedOcc 0
2 mol 169 unq 0 iso 0 dist 8.77324 5.73931 6.27378 6.85177 10.1931 5.10589 numMergedOcc 0
3 mol 169 unq 1 iso 0 dist 8.77324 5.73931 6.27378 8.88729 10.5136 4.63336 numMergedOcc 0
4 mol 169 unq 2 iso 0 dist 8.77324 5.73931 6.27378 11.5631 10.212 6.10715 numMergedOcc 0
5 mol 233 unq 0 iso 0 dist 8.08374 8.59304 8.18379 12.1416 5.38659 9.80479 numMergedOcc 0
6 mol 260 unq 0 iso 0 dist 8.88803 9.96926 4.76164 10.1475 9.45061 8.62655 numMergedOcc 0
7 mol 266 unq 0 iso 0 dist 9.17075 6.80038 6.39822 7.96613 10.1418 7.8598 numMergedOcc 0
8 mol 266 unq 1 iso 0 dist 9.17075 6.80038 6.39822 14.3456 7.63149 8.25286 numMergedOcc 0
9 mol 266 unq 2 iso 0 dist 9.17075 4.5731 5.36518 7.96613 10.1418 7.80711 numMergedOcc 0
10 mol 266 unq 3 iso 0 dist 9.17075 4.5731 5.36518 14.3456 7.63149 9.9965 numMergedOcc 0
11 mol 266 unq 4 iso 0 dist 7.68224 12.6856 6.39822 17.7868 10.1418 7.8598 numMergedOcc 0
12 mol 266 unq 5 iso 0 dist 7.68224 12.6856 6.39822 10.7962 7.63149 8.25286 numMergedOcc 0
13 mol 266 unq 6 iso 0 dist 7.68224 12.0551 5.36518 17.7868 10.1418 7.80711 numMergedOcc 0
14 mol 266 unq 7 iso 0 dist 7.68224 12.0551 5.36518 10.7962 7.63149 9.9965 numMergedOcc 0
15 mol 266 unq 8 iso 0 dist 9.8751 14.936 9.90506 10.7962 4.39553 6.96692 numMergedOcc 0
16 mol 266 unq 9 iso 0 dist 9.8751 12.6856 8.61077 17.7868 10.3155 7.8598 numMergedOcc 0
17 mol 266 unq 10 iso 0 dist 9.8751 12.6856 8.61077 10.7962 4.39553 8.25286 numMergedOcc 0
18 mol 266 unq 11 iso 0 dist 9.8751 12.0551 9.11585 17.7868 10.3155 7.80711 numMergedOcc 0
19 mol 266 unq 12 iso 0 dist 9.8751 12.0551 9.11585 10.7962 4.39553 9.9965 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.90911 17.5861 9.07744 16.6039 9.21484 7.98956 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 8.90911 17.5861 9.07744 18.237 10.3506 5.86185 numMergedOcc 0
22 mol 277 unq 2 iso 0 dist 8.90911 17.5861 9.07744 16.9749 10.4629 6.79748 numMergedOcc 0
23 mol 281 unq 0 iso 0 dist 5.84757 10.8706 9.39268 12.2306 12.4082 7.90368 numMergedOcc 0
24 mol 281 unq 1 iso 0 dist 5.84757 10.8706 9.39268 14.666 10.4439 6.69267 numMergedOcc 0
25 mol 281 unq 2 iso 0 dist 5.0007 7.60311 9.39268 7.8046 12.4082 7.90368 numMergedOcc 0
26 mol 281 unq 3 iso 0 dist 5.0007 7.60311 9.39268 11.1901 10.4439 6.69267 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 5.1936 4.69872 5.44942 8.27196 5.1451 6.24487 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 5.1936 4.69872 5.44942 8.27196 5.1451 6.24487 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 5.1936 4.69872 5.44942 8.27196 5.1451 6.24487 numMergedOcc 0
