0 mol 7 unq 0 iso 0 dist 7.13259 9.20552 4.78012 13.6107 13.1453 8.8576 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.74842 8.64855 12.647 5.5336 13.3137 7.0208 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 8.74842 8.64855 12.647 5.39895 13.4143 7.28563 numMergedOcc 0
3 mol 14 unq 2 iso 0 dist 5.40648 7.94714 4.52143 7.70341 6.99915 8.51112 numMergedOcc 0
4 mol 14 unq 3 iso 0 dist 8.4114 7.94714 11.1113 7.70341 15.5115 8.51112 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 7.81257 6.84521 7.23774 5.00932 12.4121 8.99509 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 7.81257 8.90024 12.092 5.00932 12.4121 8.47617 numMergedOcc 0
7 mol 43 unq 2 iso 0 dist 7.81257 6.78532 10.7423 5.00932 12.4121 5.73331 numMergedOcc 0
8 mol 51 unq 0 iso 0 dist 9.53744 6.67213 5.8664 5.44727 11.3162 8.99612 numMergedOcc 0
9 mol 89 unq 0 iso 0 dist 9.04932 8.85873 12.1771 5.19804 12.209 5.25504 numMergedOcc 0
10 mol 89 unq 1 iso 0 dist 9.04932 7.3606 5.91348 5.19804 12.209 7.84991 numMergedOcc 0
11 mol 96 unq 0 iso 0 dist 8.05324 9.93617 11.7313 5.68919 8.94847 6.19867 numMergedOcc 0
12 mol 96 unq 1 iso 0 dist 8.05324 9.93617 11.7313 14.5513 18.7633 8.35452 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 9.92308 7.2443 6.20962 8.94648 15.0273 9.57352 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 6.12598 8.47907 11.4252 8.96396 14.7885 8.054 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 9.17599 7.30919 10.3773 14.4662 12.1369 8.75736 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 9.17599 7.30919 10.3773 12.021 12.9804 6.76166 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 8.78704 7.30919 5.11977 14.4662 10.4767 8.75736 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 8.78704 7.30919 5.11977 12.021 10.7737 6.76166 numMergedOcc 0
19 mol 196 unq 0 iso 0 dist 8.24466 9.36732 7.08535 14.2286 7.21836 7.23126 numMergedOcc 0
20 mol 196 unq 1 iso 0 dist 8.24466 9.36732 7.08535 16.543 13.0442 7.82805 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 8.41937 7.70631 8.75322 10.0858 15.0056 9.14737 numMergedOcc 0
22 mol 248 unq 0 iso 0 dist 8.2748 7.40475 6.21372 11.4636 11.5556 9.5107 numMergedOcc 0
