0 mol 30 unq 0 iso 0 dist 6.88974 7.3557 5.53425 7.5925 5.5814 8.98564 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 5.5814 8.98564 5.53425 7.5925 6.88974 7.3557 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 9.96265 7.61923 6.16718 5.12876 9.70459 5.11941 numMergedOcc 0
3 mol 44 unq 1 iso 0 dist 9.96265 7.61923 6.16718 6.85995 7.78905 5.84744 numMergedOcc 0
4 mol 44 unq 2 iso 0 dist 9.96265 7.61923 6.16718 10.0258 12.0965 7.7864 numMergedOcc 0
5 mol 44 unq 3 iso 0 dist 9.70459 5.11941 6.16718 5.12876 9.96265 7.61923 numMergedOcc 0
6 mol 44 unq 4 iso 0 dist 9.70459 5.11941 6.16718 4.19085 7.78905 5.84744 numMergedOcc 0
7 mol 44 unq 5 iso 0 dist 9.70459 5.11941 6.16718 5.12368 12.0965 7.7864 numMergedOcc 0
8 mol 44 unq 6 iso 0 dist 7.78905 5.84744 6.16718 6.85995 9.96265 7.61923 numMergedOcc 0
9 mol 44 unq 7 iso 0 dist 7.78905 5.84744 6.16718 4.19085 9.70459 5.11941 numMergedOcc 0
10 mol 44 unq 8 iso 0 dist 7.78905 5.84744 6.16718 5.46286 12.0965 7.7864 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 5.9747 7.34638 7.03983 4.24815 4.50572 6.0995 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 4.50572 6.0995 7.03983 4.24815 5.9747 7.34638 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 8.3164 9.94704 5.00433 6.79125 11.1103 9.46621 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 6.90827 6.78655 3.55765 5.70541 8.90977 9.42037 numMergedOcc 0
15 mol 117 unq 1 iso 0 dist 8.90977 9.42037 3.55765 5.70541 6.90827 6.78655 numMergedOcc 0
16 mol 128 unq 0 iso 0 dist 8.01677 9.45412 10.0888 10.0842 13.869 7.95999 numMergedOcc 0
17 mol 129 unq 0 iso 0 dist 6.38163 6.53559 6.28232 10.4144 12.0922 8.09774 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.752 6.41148 8.67921 4.20051 5.4913 5.06713 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 8.10287 5.06713 8.90569 4.20051 12.1752 6.41148 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 5.4913 5.06713 8.67921 4.20051 6.752 6.41148 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 9.94315 7.13727 7.06793 5.00891 8.59074 8.56975 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 8.59074 8.56975 7.06793 5.00891 9.94315 7.13727 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 7.36905 9.13546 5.71153 12.3243 11.1873 7.19658 numMergedOcc 0
24 mol 264 unq 1 iso 0 dist 6.83408 9.13546 6.56539 12.3243 10.6712 7.19658 numMergedOcc 0
