0 mol 5 unq 0 iso 0 dist 7.15734 6.93063 10.0814 7.86627 9.58245 4.006 numMergedOcc 0
1 mol 5 unq 0 iso 1 dist 7.15734 7.86627 9.58245 6.93063 10.0814 4.006 numMergedOcc 0
2 mol 66 unq 0 iso 0 dist 8.95789 9.28525 6.86331 8.55807 9.37607 3.81162 numMergedOcc 0
3 mol 66 unq 0 iso 1 dist 8.95789 8.55807 9.37607 9.28525 6.86331 3.81162 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 5.78962 9.00799 7.15588 6.29207 8.74291 14.0626 numMergedOcc 0
5 mol 91 unq 0 iso 1 dist 5.78962 6.29207 8.74291 9.00799 7.15588 14.0626 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.18835 8.03269 13.298 6.55349 9.29137 4.14801 numMergedOcc 0
7 mol 120 unq 0 iso 1 dist 9.18835 6.55349 9.29137 8.03269 13.298 4.14801 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 8.98459 7.98503 6.79626 7.80955 8.44832 10.6873 numMergedOcc 0
9 mol 162 unq 0 iso 1 dist 8.98459 7.80955 8.44832 7.98503 6.79626 10.6873 numMergedOcc 0
10 mol 162 unq 1 iso 0 dist 8.98459 7.98503 6.79626 7.93307 13.1065 9.55574 numMergedOcc 0
11 mol 162 unq 1 iso 1 dist 8.98459 7.93307 13.1065 7.98503 6.79626 9.55574 numMergedOcc 0
12 mol 162 unq 1 iso 0 dist 8.98459 7.80955 8.44832 7.93307 13.1065 9.12022 numMergedOcc 0
13 mol 162 unq 1 iso 1 dist 8.98459 7.93307 13.1065 7.80955 8.44832 9.12022 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 5.97008 7.90789 8.51683 4.13397 8.00155 6.43952 numMergedOcc 0
15 mol 173 unq 0 iso 1 dist 5.97008 4.13397 8.00155 7.90789 8.51683 6.43952 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 7.35148 8.01243 5.72234 9.55264 13.2318 16.7141 numMergedOcc 0
17 mol 220 unq 0 iso 1 dist 7.35148 9.55264 13.2318 8.01243 5.72234 16.7141 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 7.53352 8.5291 12.5167 9.32852 16.0777 6.55158 numMergedOcc 0
19 mol 254 unq 0 iso 1 dist 7.53352 9.32852 16.0777 8.5291 12.5167 6.55158 numMergedOcc 0
20 mol 254 unq 1 iso 0 dist 7.80793 8.5291 8.03226 9.32852 13.263 6.55158 numMergedOcc 0
21 mol 254 unq 1 iso 1 dist 7.80793 9.32852 13.263 8.5291 8.03226 6.55158 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.57305 5.75291 10.1386 7.17822 10.3067 9.04167 numMergedOcc 0
23 mol 258 unq 0 iso 1 dist 8.57305 7.17822 10.3067 5.75291 10.1386 9.04167 numMergedOcc 0
24 mol 280 unq 0 iso 0 dist 8.57733 7.8766 3.77655 7.70759 9.99391 9.45091 numMergedOcc 0
25 mol 280 unq 0 iso 1 dist 8.57733 7.70759 9.99391 7.8766 3.77655 9.45091 numMergedOcc 0
26 mol 280 unq 1 iso 0 dist 9.05509 7.8766 8.87395 7.70759 8.05876 9.45091 numMergedOcc 0
27 mol 280 unq 1 iso 1 dist 9.05509 7.70759 8.05876 7.8766 8.87395 9.45091 numMergedOcc 0
28 mol 280 unq 2 iso 0 dist 6.83927 9.94082 8.23689 9.9882 5.63061 4.05935 numMergedOcc 0
29 mol 280 unq 2 iso 1 dist 6.83927 9.9882 5.63061 9.94082 8.23689 4.05935 numMergedOcc 0
30 mol 284 unq 0 iso 0 dist 9.47963 8.52276 4.91763 7.55623 4.127 4.31963 numMergedOcc 0
31 mol 284 unq 0 iso 1 dist 9.47963 7.55623 4.127 8.52276 4.91763 4.31963 numMergedOcc 0
