0 mol 58 unq 0 iso 0 dist 6.88243 12.0778 7.03126 5.22484 9.02642 11.6859 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 6.88243 6.39539 9.68228 5.22484 9.02642 10.8453 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 9.56474 10.2536 6.52887 5.54243 8.65144 5.80538 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 5.9959 8.01541 8.50705 6.49911 9.94998 5.93461 numMergedOcc 0
4 mol 155 unq 0 iso 0 dist 5.55218 5.49358 7.29911 12.2688 9.16358 9.50478 numMergedOcc 0
5 mol 155 unq 1 iso 0 dist 5.55218 5.49358 7.29911 12.1461 9.24038 12.0574 numMergedOcc 0
6 mol 155 unq 2 iso 0 dist 5.55218 7.00069 5.36254 12.2688 9.16358 5.50045 numMergedOcc 0
7 mol 155 unq 3 iso 0 dist 5.55218 7.00069 5.36254 12.1461 9.24038 6.40403 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 8.39573 11.4382 6.76746 5.39949 5.99437 7.30555 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 5.61604 6.7915 5.73635 9.63375 8.62102 5.8726 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 8.44337 10.9154 5.79911 11.8686 8.15661 4.58486 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 7.75518 7.60926 9.74988 13.3905 9.24936 11.5313 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 6.0155 12.5858 9.58372 5.74127 5.44533 10.8576 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 8.57781 11.3098 5.73591 5.93235 5.05368 6.957 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 8.57781 12.4483 8.55345 5.93235 5.05368 7.16077 numMergedOcc 0
15 mol 224 unq 2 iso 0 dist 5.36326 9.20195 5.73591 6.66792 5.05368 6.957 numMergedOcc 0
16 mol 224 unq 3 iso 0 dist 5.36326 9.72892 8.55345 6.66792 5.05368 7.16077 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 6.95569 10.5519 9.06937 4.30863 5.61969 6.2726 numMergedOcc 0
18 mol 273 unq 1 iso 0 dist 6.95569 10.5519 9.06937 7.71446 9.0277 5.33053 numMergedOcc 0
