0 mol 20 unq 0 iso 0 dist 7.89835 4.14436 7.14069 9.14371 4.95725 6.09764 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.94205 4.14436 8.58641 9.14371 5.84217 6.09764 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 9.08453 4.14436 5.99466 9.14371 4.18921 6.09764 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 9.08453 9.3714 9.07213 9.14371 4.18921 9.20198 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 9.08453 9.3714 9.07213 13.9972 16.3456 7.51452 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 9.78903 13.8528 8.49709 17.7366 13.0212 9.01567 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 8.83657 10.7321 9.98592 10.3112 4.79736 8.44664 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 6.40189 4.98286 4.5711 10.6956 6.28159 8.23446 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 5.22014 4.98286 4.44526 10.6956 5.50396 8.23446 numMergedOcc 0
9 mol 24 unq 4 iso 0 dist 5.22014 12.988 9.586 10.6956 5.50396 8.75662 numMergedOcc 0
10 mol 24 unq 5 iso 0 dist 5.22014 12.988 9.586 16.6632 14.4081 9.44691 numMergedOcc 0
11 mol 24 unq 6 iso 0 dist 6.74914 6.3045 9.98592 6.80849 4.79736 8.44664 numMergedOcc 0
12 mol 25 unq 0 iso 0 dist 8.26412 4.93307 6.29797 11.2263 5.86705 6.85556 numMergedOcc 0
13 mol 41 unq 0 iso 0 dist 6.64721 8.92159 6.21128 16.7086 13.4019 8.51663 numMergedOcc 0
14 mol 41 unq 1 iso 0 dist 9.36169 6.17678 6.21128 13.1441 13.4019 8.51663 numMergedOcc 0
15 mol 58 unq 0 iso 0 dist 9.1791 4.7391 7.58739 9.74058 11.3019 8.80614 numMergedOcc 0
16 mol 58 unq 1 iso 0 dist 6.86485 4.7391 9.01564 9.74058 9.87158 8.80614 numMergedOcc 0
17 mol 58 unq 2 iso 0 dist 8.37546 4.7391 7.11065 9.74058 5.86526 8.80614 numMergedOcc 0
18 mol 58 unq 3 iso 0 dist 8.26586 4.35705 7.58739 12.818 11.3019 8.80614 numMergedOcc 0
19 mol 58 unq 4 iso 0 dist 9.76234 4.35705 9.01564 12.818 9.87158 8.80614 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 6.24296 4.32784 5.05893 10.6752 11.9064 9.82915 numMergedOcc 0
21 mol 85 unq 1 iso 0 dist 6.83218 4.32784 5.71866 10.6752 14.7521 9.82915 numMergedOcc 0
22 mol 91 unq 0 iso 0 dist 6.64714 5.75219 8.77355 8.00525 12.6799 9.30539 numMergedOcc 0
23 mol 98 unq 0 iso 0 dist 5.44426 9.0917 4.62494 4.31067 3.9764 6.65501 numMergedOcc 0
24 mol 98 unq 1 iso 0 dist 8.65429 16.4829 8.46823 15.6411 10.4782 6.65501 numMergedOcc 0
25 mol 129 unq 0 iso 0 dist 8.62413 6.02377 6.34626 10.3205 6.28232 7.58957 numMergedOcc 0
26 mol 133 unq 0 iso 0 dist 7.33743 8.11294 8.83732 12.8006 13.0405 6.16242 numMergedOcc 0
27 mol 133 unq 1 iso 0 dist 7.33743 8.11294 8.83732 9.73536 13.7612 5.87634 numMergedOcc 0
28 mol 159 unq 0 iso 0 dist 9.31829 10.1415 9.35202 12.2095 4.48323 8.4858 numMergedOcc 0
29 mol 181 unq 0 iso 0 dist 9.19831 6.15536 8.59681 9.50454 4.61184 5.9176 numMergedOcc 0
30 mol 181 unq 1 iso 0 dist 7.83476 4.19412 8.12266 9.72791 10.6474 5.9176 numMergedOcc 0
31 mol 212 unq 0 iso 0 dist 5.10392 10.0809 9.10288 8.13678 3.9436 8.69988 numMergedOcc 0
32 mol 212 unq 1 iso 0 dist 5.10392 6.27773 6.19798 8.13678 3.9436 8.55903 numMergedOcc 0
33 mol 222 unq 0 iso 0 dist 8.79662 10.4451 8.23406 16.3367 9.53117 7.67576 numMergedOcc 0
34 mol 232 unq 0 iso 0 dist 8.22129 5.79979 6.59036 12.6389 5.42461 9.05071 numMergedOcc 0
