0 mol 56 unq 0 iso 0 dist 9.113 11.8999 9.03564 12.6222 6.75591 8.66265 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 6.05967 8.36426 9.36001 8.79958 5.31547 9.64443 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 8.30892 8.55171 7.06939 8.79958 4.3481 9.33898 numMergedOcc 0
3 mol 92 unq 2 iso 0 dist 5.85831 6.01412 7.06939 9.1944 4.3481 9.33898 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.92003 5.2048 9.3948 9.02255 3.94537 7.27724 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 9.92003 5.2048 9.3948 12.985 11.3215 8.03644 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 9.13688 4.98369 9.74607 7.89797 6.12605 7.27724 numMergedOcc 0
7 mol 95 unq 3 iso 0 dist 9.13688 4.98369 9.74607 6.12086 5.06946 8.03644 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 9.94147 11.625 7.54889 14.4838 10.4782 6.10456 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.0775 9.65197 7.02507 12.4904 7.03983 6.48948 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 7.47769 9.80725 8.52024 5.8729 5.00433 8.69985 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 7.20006 9.76925 8.47988 11.5499 6.95317 7.71338 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 9.73134 10.3652 8.80934 12.6638 5.70579 5.86073 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 8.26759 5.0869 8.77023 5.44721 13.0405 6.29155 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 8.26759 5.0869 8.77023 10.2801 13.7612 6.80239 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 8.26759 5.0869 8.77023 12.9622 15.0115 8.00618 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.04309 15.4504 6.99769 13.1979 5.76843 6.65832 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 9.04309 14.4902 8.79428 10.5666 7.05804 6.57273 numMergedOcc 0
18 mol 224 unq 2 iso 0 dist 9.04309 14.4902 8.79428 13.1979 5.76843 6.60589 numMergedOcc 0
19 mol 224 unq 3 iso 0 dist 9.04309 6.32915 6.8692 10.5666 7.05804 5.78342 numMergedOcc 0
20 mol 224 unq 4 iso 0 dist 9.04309 6.32915 6.8692 13.1979 5.76843 9.16166 numMergedOcc 0
21 mol 224 unq 5 iso 0 dist 9.04309 6.32915 6.8692 6.7946 4.54188 5.81334 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 5.27355 7.97488 9.07743 7.9828 6.73882 8.53687 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 5.27355 7.97488 9.07743 11.9057 8.8603 8.13497 numMergedOcc 0
24 mol 259 unq 2 iso 0 dist 5.27355 6.69309 7.66153 11.9057 8.8603 7.88519 numMergedOcc 0
25 mol 259 unq 3 iso 0 dist 5.27355 6.69309 7.66153 10.0014 5.8801 7.84554 numMergedOcc 0
26 mol 259 unq 4 iso 0 dist 5.27355 6.69309 7.66153 13.3814 11.8896 7.46176 numMergedOcc 0
27 mol 259 unq 5 iso 0 dist 5.27355 6.69309 7.66153 8.73296 5.81576 9.18903 numMergedOcc 0
