0 mol 7 unq 0 iso 0 dist 6.36911 6.81066 5.28535 10.2446 7.45262 12.1093 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.36911 6.81066 5.28535 12.3097 6.96586 11.3894 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.47421 7.38017 6.21879 3.98483 8.04924 6.20227 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 9.87449 9.80484 3.8646 7.51034 8.22285 6.6347 numMergedOcc 0
4 mol 74 unq 0 iso 0 dist 8.96501 7.53878 9.7556 4.79817 4.79413 8.12551 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 8.39016 9.78235 3.96397 8.89062 7.54496 11.1901 numMergedOcc 0
6 mol 90 unq 1 iso 0 dist 6.99355 8.92069 3.96397 10.1287 7.54496 11.1901 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 8.40312 7.02709 4.91158 8.71052 8.13921 6.93417 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 6.19042 8.20715 4.15435 7.61939 9.87025 8.81779 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 7.44174 8.20715 9.54775 9.15779 9.05798 15.9765 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 7.44174 8.20715 9.54775 7.61939 5.85818 8.81779 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 8.43904 6.16081 4.15435 10.326 9.87025 8.81779 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 7.31468 9.3169 6.45748 6.41287 8.1582 13.375 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 7.31468 9.3169 6.45748 7.11704 7.88655 12.2875 numMergedOcc 0
14 mol 143 unq 2 iso 0 dist 7.7056 5.5639 6.45748 11.488 8.1582 13.375 numMergedOcc 0
15 mol 143 unq 3 iso 0 dist 7.7056 5.5639 6.45748 9.53139 7.88655 12.2875 numMergedOcc 0
16 mol 163 unq 0 iso 0 dist 9.19209 9.26162 4.22082 3.89889 5.92747 7.38157 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 8.36822 8.63044 7.31685 7.0057 8.53433 11.7104 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 9.19704 7.23959 10.0576 5.54129 9.83885 5.96238 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 9.19704 7.23959 10.0576 5.28092 5.42696 7.85966 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 8.60247 7.06087 4.77836 6.214 5.10114 7.48626 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 7.18041 6.48765 7.51787 5.7776 6.86795 10.932 numMergedOcc 0
22 mol 218 unq 1 iso 0 dist 7.18041 6.48765 7.51787 5.282 6.23898 6.45821 numMergedOcc 0
23 mol 218 unq 2 iso 0 dist 7.17547 6.48765 12.2094 10.3246 9.67381 16.512 numMergedOcc 0
24 mol 218 unq 3 iso 0 dist 7.17547 6.48765 12.2094 5.7776 6.61099 10.932 numMergedOcc 0
