0 mol 32 unq 0 iso 0 dist 5.73722 4.14768 6.19304 10.12 11.7888 7.99969 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.36132 9.29368 5.67362 10.9015 5.46309 9.25641 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 9.25716 8.95347 9.87414 12.8437 6.21391 8.39111 numMergedOcc 0
3 mol 96 unq 1 iso 0 dist 6.29224 5.77655 9.87414 8.92287 6.21391 8.39111 numMergedOcc 0
4 mol 96 unq 2 iso 0 dist 8.14767 5.77655 8.9536 8.92287 4.86104 8.39111 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 3.90209 7.65932 8.48678 12.9741 13.9683 6.7117 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 3.90209 7.65932 8.48678 11.233 11.0642 4.47349 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 3.90209 7.65932 8.48678 9.48388 7.71768 5.65185 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.06422 16.3243 8.61574 16.604 10.5726 9.23858 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.91629 12.0238 5.43662 6.44766 5.29825 8.70296 numMergedOcc 0
10 mol 180 unq 0 iso 0 dist 7.11542 8.09502 9.59587 7.24785 6.93557 5.85827 numMergedOcc 0
11 mol 180 unq 1 iso 0 dist 6.43834 5.6141 9.59587 7.53287 6.93557 5.85827 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.34778 5.80123 5.77158 12.7161 5.87924 7.66165 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 6.03801 8.69113 5.77158 11.9058 5.87924 7.66165 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 5.24705 4.64654 6.62013 9.9539 7.24163 7.32294 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 7.58016 5.9053 6.02803 13.1056 6.6871 8.80683 numMergedOcc 0
16 mol 226 unq 1 iso 0 dist 7.58016 5.9053 6.02803 11.1425 6.19485 6.11704 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 4.88851 5.99141 6.47859 13.1101 9.78463 9.01021 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 5.84481 6.4111 5.24993 11.0889 5.87119 6.78191 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 7.06322 4.59906 6.68183 6.07571 5.81799 7.07965 numMergedOcc 0
