0 mol 20 unq 0 iso 0 dist 8.36009 12.1601 8.26091 10.2538 3.59314 8.72342 numMergedOcc 0
1 mol 31 unq 0 iso 0 dist 9.99589 4.46909 9.95496 10.777 3.57805 9.67338 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.51631 8.24064 7.7485 8.44761 3.56619 9.87699 numMergedOcc 0
3 mol 107 unq 0 iso 0 dist 7.09988 14.3565 8.19484 14.2999 8.49625 7.89505 numMergedOcc 0
4 mol 107 unq 1 iso 0 dist 7.73898 11.5335 8.19484 12.634 8.49625 7.89505 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 6.36631 5.86518 5.31126 10.8474 6.29259 7.40338 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 6.36631 5.86518 5.31126 10.7006 8.17309 6.23759 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 6.24308 5.86518 7.16619 10.8474 7.08122 7.40338 numMergedOcc 0
8 mol 113 unq 3 iso 0 dist 6.24308 5.86518 7.16619 10.7006 9.30967 6.23759 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 4.26814 5.15271 6.08651 9.59568 6.30769 7.4442 numMergedOcc 0
10 mol 128 unq 1 iso 0 dist 7.66528 5.43682 6.08651 4.89256 6.30769 7.4442 numMergedOcc 0
11 mol 128 unq 2 iso 0 dist 9.40919 7.78871 6.08651 10.5911 6.30769 7.4442 numMergedOcc 0
12 mol 169 unq 0 iso 0 dist 6.85177 5.73931 5.10589 13.2863 14.1141 9.84538 numMergedOcc 0
13 mol 169 unq 1 iso 0 dist 8.88729 5.73931 4.63336 13.2863 13.1539 9.84538 numMergedOcc 0
14 mol 169 unq 2 iso 0 dist 7.07933 12.9917 6.96715 9.71763 3.83687 5.41121 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 9.32969 7.35757 5.10542 11.2921 3.7326 8.43182 numMergedOcc 0
16 mol 198 unq 0 iso 0 dist 9.84293 6.88195 7.38825 9.75046 5.92533 8.78623 numMergedOcc 0
17 mol 198 unq 1 iso 0 dist 5.84588 5.73959 7.38825 6.73371 5.92533 8.78623 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 8.42431 11.9686 6.80296 15.1627 9.36584 7.9416 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 7.93054 4.26898 7.42759 9.10678 7.23583 8.41013 numMergedOcc 0
20 mol 254 unq 0 iso 0 dist 8.80049 15.5851 9.20109 15.6029 11.9238 9.50951 numMergedOcc 0
21 mol 254 unq 1 iso 0 dist 8.26189 12.399 7.85841 18.8027 11.0708 9.31434 numMergedOcc 0
22 mol 254 unq 2 iso 0 dist 7.57834 12.6878 9.20109 19.1271 13.4911 9.31434 numMergedOcc 0
23 mol 254 unq 3 iso 0 dist 5.75348 12.399 9.20109 18.8027 13.4911 9.31434 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 4.54064 8.11438 7.04263 4.76698 3.60349 6.12343 numMergedOcc 0
25 mol 260 unq 1 iso 0 dist 4.54064 3.43932 6.48099 4.76698 3.60349 4.52405 numMergedOcc 0
26 mol 260 unq 2 iso 0 dist 5.33881 12.1108 8.62655 12.2712 7.28821 6.49413 numMergedOcc 0
27 mol 281 unq 0 iso 0 dist 9.73306 12.2582 7.90368 11.7801 3.78169 6.18742 numMergedOcc 0
28 mol 281 unq 1 iso 0 dist 7.8046 7.60311 7.90368 9.42297 3.78169 6.18742 numMergedOcc 0
29 mol 285 unq 0 iso 0 dist 5.93983 8.32005 5.88958 13.1011 8.78384 8.79261 numMergedOcc 0
30 mol 285 unq 1 iso 0 dist 5.93983 7.07384 7.78121 13.1011 8.78384 9.99125 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 8.06614 7.34358 8.07775 10.2691 5.06937 5.91617 numMergedOcc 0
