0 mol 7 unq 0 iso 0 dist 6.36911 9.68596 13.0969 9.87885 7.92429 10.1841 13.2247 9.36807 12.9581 6.1206 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 9.64665 5.93884 5.27642 9.22598 8.59939 5.66912 4.81926 9.66798 7.68678 8.96727 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 8.89374 7.68678 12.0055 8.96727 14.6599 5.66912 4.81926 11.5023 5.93884 9.22598 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 6.77912 9.27838 4.67641 7.12321 9.88768 14.005 5.36766 8.624 11.1896 9.74228 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 6.77912 9.27838 4.67641 7.12321 9.88768 14.005 8.24309 11.9814 16.0048 6.21799 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.13087 6.02816 6.93907 5.61588 8.97361 8.26195 8.07446 13.6145 12.4089 5.5087 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 7.13087 6.02816 6.93907 7.83244 10.2983 12.382 8.07446 13.6145 12.4089 6.08682 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 8.62646 9.67741 7.31643 9.2289 7.0046 8.91275 4.70068 10.5089 11.6896 7.68266 numMergedOcc 0
8 mol 167 unq 1 iso 0 dist 8.62646 9.67741 7.31643 9.2289 7.0046 8.91275 10.3445 13.6191 12.8466 7.6616 numMergedOcc 0
9 mol 167 unq 2 iso 0 dist 8.62646 9.67741 7.31643 7.02548 6.24722 5.95858 4.70068 10.5089 11.6896 6.84752 numMergedOcc 0
10 mol 167 unq 3 iso 0 dist 8.62646 9.67741 7.31643 7.02548 6.24722 5.95858 10.3445 13.6191 12.8466 7.86563 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 7.98142 5.94469 8.93991 9.01624 12.2513 11.9796 11.5866 16.7285 14.8638 5.05973 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 7.37327 5.94469 5.35588 9.01624 14.8923 11.9796 11.5866 18.3916 14.8638 5.05973 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 4.87541 7.59632 3.92926 4.33238 3.78261 5.75906 7.02195 10.105 10.3776 7.83604 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 6.98084 8.69356 11.921 8.19317 4.47008 10.0135 7.218 7.32211 10.3932 5.1823 numMergedOcc 0
15 mol 235 unq 1 iso 0 dist 6.98084 8.69356 11.921 6.29377 7.34601 5.2878 7.218 7.32211 10.3932 5.70635 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.29858 9.24557 10.3809 9.72188 11.7938 17.1065 15.7907 12.3367 21.6822 9.12776 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 9.454 7.83341 6.93991 9.9182 8.68456 13.4805 10.3106 13.8513 16.7493 7.30758 numMergedOcc 0
18 mol 292 unq 1 iso 0 dist 9.454 7.83341 6.93991 9.9182 8.68456 13.4805 12.1693 14.0515 16.0086 9.10788 numMergedOcc 0
19 mol 292 unq 2 iso 0 dist 9.454 7.83341 6.93991 8.9221 7.29981 8.14131 12.1693 14.0515 16.0086 8.85064 numMergedOcc 0
