0 mol 37 unq 0 iso 0 dist 7.28798 11.5835 9.72316 5.50862 7.17889 6.29622 numMergedOcc 0
1 mol 37 unq 1 iso 0 dist 7.28798 11.5835 9.72316 9.34813 8.38803 6.55499 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.47819 7.05787 6.59498 6.13818 9.51017 5.41984 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 5.47819 7.05787 6.59498 4.32318 8.47212 9.64296 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.49371 8.32084 4.65085 3.98395 8.92491 6.03473 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.49371 8.32084 4.65085 14.6064 7.41861 6.68667 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 5.05941 7.3009 4.65085 10.3277 8.92491 6.03473 numMergedOcc 0
7 mol 76 unq 3 iso 0 dist 5.05941 7.3009 4.65085 9.02965 7.41861 6.68667 numMergedOcc 0
8 mol 76 unq 4 iso 0 dist 9.66942 9.12708 4.65085 10.7432 8.92491 6.03473 numMergedOcc 0
9 mol 76 unq 5 iso 0 dist 9.66942 9.12708 4.65085 10.6763 7.41861 6.68667 numMergedOcc 0
10 mol 99 unq 0 iso 0 dist 7.55765 7.26256 9.59191 10.4215 5.61946 9.50488 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 8.46957 14.5686 9.37079 9.73438 8.17814 8.19323 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 8.46957 14.5686 9.37079 10.7854 9.14434 8.4137 numMergedOcc 0
13 mol 172 unq 0 iso 0 dist 9.91479 13.3984 9.56872 5.06659 8.03804 10.3497 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 6.69338 10.2982 9.96744 7.85772 8.25609 6.23846 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 8.1637 9.18421 9.96744 12.0152 8.25609 6.23846 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.621 10.8931 7.74806 11.3391 6.97662 5.19872 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 6.25959 6.29451 6.39109 6.03685 7.21531 3.81516 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 7.90944 7.54602 9.43397 10.9366 4.53228 10.7844 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 7.90944 7.54602 9.43397 10.3819 8.54078 10.2329 numMergedOcc 0
