0 mol 7 unq 0 iso 0 dist 5.51421 7.81271 5.13353 3.52338 7.78327 10.1124 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 4.88613 6.36193 4.81926 6.09663 7.17488 9.9105 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 9.00229 8.05508 11.2395 4.82623 8.30217 12.3441 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 7.74197 7.86537 5.57085 12.4888 9.07128 10.3871 numMergedOcc 0
4 mol 88 unq 1 iso 0 dist 7.74197 7.86537 5.57085 6.15983 6.65615 5.07548 numMergedOcc 0
5 mol 88 unq 2 iso 0 dist 7.74197 6.35462 9.94966 12.4888 9.07128 17.5257 numMergedOcc 0
6 mol 88 unq 3 iso 0 dist 7.74197 6.35462 9.94966 6.15983 6.65615 11.7451 numMergedOcc 0
7 mol 88 unq 4 iso 0 dist 7.86537 7.74197 5.57085 6.15983 5.07548 6.65615 numMergedOcc 0
8 mol 88 unq 5 iso 0 dist 7.86537 6.35462 10.9968 6.15983 5.07548 11.7451 numMergedOcc 0
9 mol 88 unq 6 iso 0 dist 6.35462 7.74197 9.94966 4.56066 7.74064 10.7263 numMergedOcc 0
10 mol 88 unq 7 iso 0 dist 6.35462 7.86537 10.9968 4.56066 7.74064 12.2051 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 8.4545 7.01176 5.04493 8.46944 5.42067 7.36435 numMergedOcc 0
12 mol 92 unq 1 iso 0 dist 7.01176 8.4545 5.04493 8.46944 7.36435 5.42067 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 7.91337 6.40546 8.61848 3.80816 4.80684 7.60162 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 6.40546 7.91337 8.61848 3.80816 7.60162 4.80684 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 9.28278 8.78082 10.5871 3.54691 7.97548 7.32151 numMergedOcc 0
16 mol 129 unq 1 iso 0 dist 9.28278 8.78082 10.5871 5.56761 9.64164 13.0781 numMergedOcc 0
17 mol 129 unq 2 iso 0 dist 8.78082 9.28278 10.5871 3.54691 7.32151 7.97548 numMergedOcc 0
18 mol 183 unq 0 iso 0 dist 7.07224 5.83071 6.37803 3.4049 9.96536 8.5835 numMergedOcc 0
19 mol 183 unq 1 iso 0 dist 7.07224 9.82101 7.29791 3.4049 9.96536 11.4574 numMergedOcc 0
20 mol 196 unq 0 iso 0 dist 6.25429 6.87731 7.5617 7.96489 4.67869 11.2788 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 8.3337 5.41292 6.75702 3.70636 9.23086 8.37086 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 5.41292 8.3337 6.75702 3.70636 8.37086 9.23086 numMergedOcc 0
23 mol 206 unq 0 iso 0 dist 9.36079 8.46319 7.73294 12.9317 4.51255 8.65714 numMergedOcc 0
24 mol 206 unq 1 iso 0 dist 7.42904 9.11298 7.73294 10.8126 4.51255 8.65714 numMergedOcc 0
25 mol 218 unq 0 iso 0 dist 7.73315 7.0843 4.72474 14.9642 7.84952 11.8692 numMergedOcc 0
26 mol 218 unq 1 iso 0 dist 7.73315 6.9398 5.61978 14.9642 7.84952 12.5146 numMergedOcc 0
27 mol 237 unq 0 iso 0 dist 9.42743 9.5822 16.5066 9.06943 9.14911 15.2983 numMergedOcc 0
28 mol 257 unq 0 iso 0 dist 7.82899 6.36911 5.6276 11.7751 9.6834 14.1413 numMergedOcc 0
29 mol 261 unq 0 iso 0 dist 9.73983 8.65236 7.00201 10.4014 8.24356 12.3855 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 8.49076 9.09967 12.8986 7.72539 8.12739 13.0817 numMergedOcc 0
31 mol 274 unq 1 iso 0 dist 8.49076 9.09967 12.8986 8.78528 6.09853 16.0111 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 8.11838 7.88897 5.44531 4.20802 5.72327 5.81301 numMergedOcc 0
33 mol 277 unq 1 iso 0 dist 7.88897 8.11838 5.44531 4.20802 5.81301 5.72327 numMergedOcc 0
34 mol 277 unq 2 iso 0 dist 8.96343 8.51931 7.69449 7.9169 7.42932 12.762 numMergedOcc 0
