0 mol 8 unq 0 iso 0 dist 9.52805 5.89089 5.12111 9.78638 10.7532 6.94408 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 9.52805 9.78638 10.7532 5.89089 5.12111 6.94408 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.95078 6.61114 4.91539 6.75381 7.30592 10.1658 numMergedOcc 0
3 mol 16 unq 0 iso 1 dist 6.95078 6.75381 7.30592 6.61114 4.91539 10.1658 numMergedOcc 0
4 mol 17 unq 0 iso 0 dist 8.19749 9.55169 9.91781 9.45609 11.2397 18.1851 numMergedOcc 0
5 mol 17 unq 0 iso 1 dist 8.19749 9.45609 11.2397 9.55169 9.91781 18.1851 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 9.58408 9.27448 13.804 9.07927 16.653 6.23352 numMergedOcc 0
7 mol 25 unq 0 iso 1 dist 9.58408 9.07927 16.653 9.27448 13.804 6.23352 numMergedOcc 0
8 mol 25 unq 1 iso 0 dist 9.58408 9.27448 13.804 8.50987 16.4918 9.85159 numMergedOcc 0
9 mol 25 unq 1 iso 1 dist 9.58408 8.50987 16.4918 9.27448 13.804 9.85159 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 9.58408 9.07927 16.653 8.50987 16.4918 4.51512 numMergedOcc 0
11 mol 25 unq 1 iso 1 dist 9.58408 8.50987 16.4918 9.07927 16.653 4.51512 numMergedOcc 0
12 mol 55 unq 0 iso 0 dist 9.23092 8.75995 8.38443 6.0933 7.60951 5.43882 numMergedOcc 0
13 mol 55 unq 0 iso 1 dist 9.23092 6.0933 7.60951 8.75995 8.38443 5.43882 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 3.90209 9.58693 12.3572 9.48388 7.71768 17.7405 numMergedOcc 0
15 mol 98 unq 0 iso 1 dist 3.90209 9.48388 7.71768 9.58693 12.3572 17.7405 numMergedOcc 0
16 mol 102 unq 0 iso 0 dist 7.58293 5.79411 5.09542 9.9404 6.14255 5.49089 numMergedOcc 0
17 mol 102 unq 0 iso 1 dist 7.58293 9.9404 6.14255 5.79411 5.09542 5.49089 numMergedOcc 0
18 mol 115 unq 0 iso 0 dist 8.98702 6.61066 12.4408 6.3982 5.47689 10.4152 numMergedOcc 0
19 mol 115 unq 0 iso 1 dist 8.98702 6.3982 5.47689 6.61066 12.4408 10.4152 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 7.68999 9.68636 5.65373 7.81415 6.23084 6.84129 numMergedOcc 0
21 mol 229 unq 0 iso 1 dist 7.68999 7.81415 6.23084 9.68636 5.65373 6.84129 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 8.70264 8.58958 7.01488 7.17987 7.54044 5.88703 numMergedOcc 0
23 mol 234 unq 0 iso 1 dist 8.70264 7.17987 7.54044 8.58958 7.01488 5.88703 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 8.65727 8.26503 6.11415 9.80417 15.3755 10.7374 numMergedOcc 0
25 mol 258 unq 0 iso 1 dist 8.65727 9.80417 15.3755 8.26503 6.11415 10.7374 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 9.83069 5.71661 13.8637 8.98536 18.0966 4.84782 numMergedOcc 0
27 mol 294 unq 0 iso 1 dist 9.83069 8.98536 18.0966 5.71661 13.8637 4.84782 numMergedOcc 0
