0 mol 16 unq 0 iso 0 dist 5.59641 6.04965 5.58451 6.32791 5.59769 9.99279 numMergedOcc 0
1 mol 16 unq 0 iso 1 dist 5.59641 6.32791 5.59769 6.04965 5.58451 9.99279 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.52568 9.55169 11.7814 9.45609 12.3854 18.1851 numMergedOcc 0
3 mol 17 unq 0 iso 1 dist 9.52568 9.45609 12.3854 9.55169 11.7814 18.1851 numMergedOcc 0
4 mol 17 unq 1 iso 0 dist 9.15735 9.55169 14.955 9.45609 7.77586 18.1851 numMergedOcc 0
5 mol 17 unq 1 iso 1 dist 9.15735 9.45609 7.77586 9.55169 14.955 18.1851 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 9.26742 9.27448 10.3386 9.07927 13.8914 6.23352 numMergedOcc 0
7 mol 25 unq 0 iso 1 dist 9.26742 9.07927 13.8914 9.27448 10.3386 6.23352 numMergedOcc 0
8 mol 25 unq 1 iso 0 dist 9.26742 9.27448 10.3386 8.50987 15.924 9.85159 numMergedOcc 0
9 mol 25 unq 1 iso 1 dist 9.26742 8.50987 15.924 9.27448 10.3386 9.85159 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 9.26742 9.07927 13.8914 8.50987 15.924 4.51512 numMergedOcc 0
11 mol 25 unq 1 iso 1 dist 9.26742 8.50987 15.924 9.07927 13.8914 4.51512 numMergedOcc 0
12 mol 45 unq 0 iso 0 dist 8.68139 9.73896 8.57764 6.96797 5.05383 5.24762 numMergedOcc 0
13 mol 45 unq 0 iso 1 dist 8.68139 6.96797 5.05383 9.73896 8.57764 5.24762 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 8.01128 9.58693 9.30656 9.48388 14.8937 17.7405 numMergedOcc 0
15 mol 98 unq 0 iso 1 dist 8.01128 9.48388 14.8937 9.58693 9.30656 17.7405 numMergedOcc 0
16 mol 101 unq 0 iso 0 dist 5.58941 8.23251 4.79998 7.42893 5.16122 8.13019 numMergedOcc 0
17 mol 101 unq 0 iso 1 dist 5.58941 7.42893 5.16122 8.23251 4.79998 8.13019 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 9.79506 8.58958 6.00143 7.17987 9.8423 5.88703 numMergedOcc 0
19 mol 234 unq 0 iso 1 dist 9.79506 7.17987 9.8423 8.58958 6.00143 5.88703 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 5.50501 6.67907 5.74377 6.0087 10.054 7.43758 numMergedOcc 0
21 mol 236 unq 0 iso 1 dist 5.50501 6.0087 10.054 6.67907 5.74377 7.43758 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 7.34573 9.0157 13.2709 9.14351 9.82483 8.34718 numMergedOcc 0
23 mol 249 unq 0 iso 1 dist 7.34573 9.14351 9.82483 9.0157 13.2709 8.34718 numMergedOcc 0
24 mol 257 unq 0 iso 0 dist 6.82161 8.99981 10.0383 6.50405 5.86413 5.6276 numMergedOcc 0
25 mol 257 unq 0 iso 1 dist 6.82161 6.50405 5.86413 8.99981 10.0383 5.6276 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 7.64578 6.45955 5.25596 8.86937 5.28447 4.84782 numMergedOcc 0
27 mol 294 unq 0 iso 1 dist 7.64578 8.86937 5.28447 6.45955 5.25596 4.84782 numMergedOcc 0
28 mol 294 unq 1 iso 0 dist 5.85292 5.71661 5.25596 8.98536 5.28447 4.84782 numMergedOcc 0
29 mol 294 unq 1 iso 1 dist 5.85292 8.98536 5.28447 5.71661 5.25596 4.84782 numMergedOcc 0
30 mol 294 unq 2 iso 0 dist 6.28096 6.45955 9.87129 8.86937 10.5605 4.84782 numMergedOcc 0
31 mol 294 unq 2 iso 1 dist 6.28096 8.86937 10.5605 6.45955 9.87129 4.84782 numMergedOcc 0
