0 mol 26 unq 0 iso 0 dist 7.71457 6.17217 5.60677 6.0606 8.13863 6.81793 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 5.98456 6.17217 4.27162 6.0606 9.72287 6.81793 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 8.6176 5.51406 6.59567 6.44712 11.042 8.77355 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 8.74617 5.59552 4.2144 5.92795 10.11 6.59716 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 8.74617 5.59552 4.2144 10.2656 8.806 6.87506 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 8.12196 8.23777 8.7368 3.82552 5.64143 5.36587 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.43487 9.66068 8.69658 8.60362 6.03035 9.30645 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 6.29634 9.34823 6.65893 5.92411 4.22806 8.67537 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 6.58803 9.04845 5.21958 5.68827 5.47256 8.83732 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 9.96967 7.94325 5.21958 10.124 5.47256 8.83732 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 6.31523 6.72323 5.21958 11.5628 5.47256 8.83732 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 9.2747 6.21194 9.23265 9.12839 15.0986 7.47964 numMergedOcc 0
12 mol 171 unq 1 iso 0 dist 8.45343 6.21194 7.86006 9.12839 10.5988 7.47964 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 6.38964 8.15381 6.97126 6.98142 11.2166 8.24419 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 6.94771 6.32097 3.42696 5.06821 9.24563 9.23863 numMergedOcc 0
