0 mol 18 unq 0 iso 0 dist 6.09533 5.9929 9.30649 3.91445 9.46349 6.92705 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.79911 5.03785 5.02954 10.0857 9.58192 7.19293 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.35779 5.0413 9.71949 5.46563 9.19512 6.35287 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 8.4702 12.6838 9.87982 3.77705 5.88409 9.4319 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.56859 4.89784 7.40437 11.7024 9.08745 7.8851 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 5.75135 4.50543 7.40437 4.69809 9.08745 7.8851 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 6.13459 8.02579 9.30843 3.91263 8.28591 4.97727 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 6.13459 8.02579 9.30843 5.59024 5.35008 5.77343 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 6.13459 8.02579 9.30843 12.9872 8.30921 11.0802 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 6.13459 12.3147 6.25522 3.91263 8.28591 13.8087 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 6.13459 12.3147 6.25522 5.59024 5.35008 9.96831 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 6.13459 12.3147 6.25522 12.9872 8.30921 5.33894 numMergedOcc 0
12 mol 93 unq 6 iso 0 dist 7.54391 12.3147 7.87145 3.91263 9.40687 13.8087 numMergedOcc 0
13 mol 93 unq 7 iso 0 dist 7.54391 12.3147 7.87145 5.59024 8.84576 9.96831 numMergedOcc 0
14 mol 93 unq 8 iso 0 dist 7.54391 12.3147 7.87145 12.9872 7.39732 5.33894 numMergedOcc 0
15 mol 113 unq 0 iso 0 dist 9.86767 5.12275 8.28325 7.09333 4.30875 7.48733 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 8.42225 7.58689 8.34342 5.99531 4.55071 9.75037 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 8.42225 5.47002 7.62197 5.99531 4.55071 6.71103 numMergedOcc 0
18 mol 119 unq 2 iso 0 dist 8.42225 15.5989 9.31621 5.99531 4.55071 12.6399 numMergedOcc 0
19 mol 169 unq 0 iso 0 dist 9.58901 5.42467 8.21203 7.0638 4.11374 7.59743 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 4.37577 9.07895 9.12783 3.6848 7.36794 12.0756 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 4.37577 9.07895 9.12783 5.33968 5.81881 9.57029 numMergedOcc 0
22 mol 255 unq 0 iso 0 dist 7.80616 5.98117 8.56885 5.98092 8.7958 5.45387 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 9.46576 14.3006 9.25019 17.1277 9.73217 9.36822 numMergedOcc 0
24 mol 260 unq 1 iso 0 dist 9.46576 14.3006 9.25019 6.73886 7.49606 14.1637 numMergedOcc 0
25 mol 260 unq 2 iso 0 dist 9.46576 14.3006 9.25019 11.1586 8.06377 12.9441 numMergedOcc 0
26 mol 260 unq 3 iso 0 dist 9.46576 7.23536 4.64695 17.1277 9.73217 13.067 numMergedOcc 0
27 mol 260 unq 4 iso 0 dist 9.46576 7.23536 4.64695 6.73886 7.49606 5.38958 numMergedOcc 0
28 mol 260 unq 5 iso 0 dist 9.46576 7.23536 4.64695 11.1586 8.06377 6.07718 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 5.96259 10.361 8.17846 3.77031 4.98693 8.11749 numMergedOcc 0
