0 mol 30 unq 0 iso 0 dist 5.64067 10.8957 9.29609 18.2954 16.4468 7.57624 numMergedOcc 0
1 mol 119 unq 0 iso 0 dist 6.13391 3.26359 4.31261 10.1343 4.68039 7.7186 numMergedOcc 0
2 mol 140 unq 0 iso 0 dist 7.85653 3.66146 9.36023 7.5639 5.19894 6.88264 numMergedOcc 0
3 mol 140 unq 1 iso 0 dist 7.85653 3.66146 9.36023 11.2325 10.5357 9.75537 numMergedOcc 0
4 mol 140 unq 2 iso 0 dist 7.5639 3.66146 6.88264 7.85653 5.19894 9.36023 numMergedOcc 0
5 mol 140 unq 3 iso 0 dist 7.5639 3.66146 6.88264 11.2325 6.20995 9.75537 numMergedOcc 0
6 mol 159 unq 0 iso 0 dist 9.91132 4.44253 9.37298 9.90625 12.3323 8.02691 numMergedOcc 0
7 mol 159 unq 1 iso 0 dist 9.90625 4.44253 8.02691 9.91132 12.3323 9.37298 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 8.9822 6.91264 9.26529 10.2142 6.05688 6.0532 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 9.52012 13.63 9.04642 10.0863 4.17181 6.03308 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 7.03236 9.87235 8.48604 12.5955 6.06777 9.35873 numMergedOcc 0
11 mol 251 unq 0 iso 0 dist 8.38382 3.43331 6.12282 10.1298 9.25693 6.99995 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 5.22349 4.28835 6.5058 9.81593 8.15279 6.77555 numMergedOcc 0
13 mol 252 unq 1 iso 0 dist 9.81593 4.28835 6.77555 5.22349 8.15279 6.5058 numMergedOcc 0
14 mol 252 unq 2 iso 0 dist 9.78248 13.9287 6.77555 17.7576 8.15279 6.5058 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 8.62966 3.62419 9.75798 8.60979 5.67353 7.64992 numMergedOcc 0
16 mol 272 unq 1 iso 0 dist 8.60979 3.62419 7.64992 8.62966 5.67353 9.75798 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 6.89391 8.06603 5.04032 13.486 7.94736 8.48397 numMergedOcc 0
