0 mol 9 unq 0 iso 0 dist 6.85412 9.62394 4.45625 5.84314 9.71516 10.9352 5.60154 9.29529 9.57198 3.91075 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.33889 9.62394 6.0397 5.84314 9.81658 10.9352 5.60154 7.2199 9.57198 3.91075 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.82012 6.46104 4.98603 5.56139 5.84066 6.07276 11.0099 11.0822 7.3022 10.267 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 8.68559 7.99969 7.14527 10.7345 7.11053 11.636 6.68431 7.48825 4.62858 8.73368 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 6.20618 7.60018 12.6602 6.75888 8.80108 8.71468 10.7257 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 8.26899 7.21955 10.8421 5.61579 7.03126 10.4354 6.75888 8.80108 8.71468 11.0945 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 9.38946 7.92304 9.50478 4.91785 7.29911 9.16358 6.34186 11.3251 9.80845 4.48516 numMergedOcc 0
7 mol 155 unq 1 iso 0 dist 7.39644 6.53347 6.40403 7.10286 5.36254 9.24038 9.36596 13.2154 9.0529 12.0485 numMergedOcc 0
8 mol 155 unq 2 iso 0 dist 7.39644 6.53347 6.40403 7.10286 5.36254 9.24038 5.40375 7.37901 7.55196 4.48516 numMergedOcc 0
9 mol 155 unq 3 iso 0 dist 7.36102 7.92304 5.50045 4.91785 5.36254 9.16358 6.34186 7.37901 9.80845 4.48516 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 5.48258 6.72379 4.26755 4.66791 7.10155 9.00322 5.38925 10.055 9.3402 6.72001 numMergedOcc 0
11 mol 194 unq 1 iso 0 dist 5.48258 6.72379 4.26755 5.97754 6.11135 9.94082 5.38925 10.055 9.3402 10.6399 numMergedOcc 0
12 mol 194 unq 2 iso 0 dist 6.15769 6.72379 10.0315 5.97754 6.54481 9.94082 5.38925 10.8707 9.3402 10.6399 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 8.19953 9.51597 6.99977 5.13732 5.73591 10.7847 7.67202 4.55996 8.08737 5.93269 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 6.16063 7.32499 7.17691 13.1872 9.11572 7.77911 5.9221 8.49841 7.43663 11.8229 numMergedOcc 0
15 mol 234 unq 1 iso 0 dist 6.16063 7.32499 7.17691 13.1872 9.11572 7.77911 13.2297 11.8534 7.94068 6.45373 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 9.58736 9.55668 13.128 13.7306 7.02029 13.3153 4.65302 11.9287 7.95766 13.7435 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 5.27215 8.69525 12.1725 10.8635 11.5207 7.04753 11.5966 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 8.09066 7.02333 11.5793 6.13368 8.69525 12.1725 5.68826 11.5207 7.04753 11.5966 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 7.2766 8.67864 11.5793 10.0605 8.69525 12.1725 4.87097 11.5207 7.04753 11.5966 numMergedOcc 0
