0 mol 37 unq 0 iso 0 dist 7.7568 6.69711 9.08524 5.49728 5.98359 9.98549 numMergedOcc 0
1 mol 37 unq 1 iso 0 dist 7.7568 6.69711 9.08524 11.0102 15.6027 8.42264 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 9.52763 7.23914 4.86374 6.31812 13.5772 9.33168 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 9.52763 7.23914 4.86374 8.39913 12.7012 7.93388 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 8.43093 6.94997 5.04401 8.85739 13.7626 9.90016 numMergedOcc 0
5 mol 86 unq 1 iso 0 dist 8.43093 6.94997 5.04401 4.2645 8.63569 8.24791 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.47957 6.98838 5.71776 7.17073 10.5281 9.0321 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 9.4046 6.98838 6.64721 7.17073 6.41105 9.0321 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.93688 7.57958 5.02124 13.3114 4.85152 6.58062 numMergedOcc 0
9 mol 99 unq 0 iso 0 dist 5.33644 4.74654 5.17028 5.36117 8.23566 8.86001 numMergedOcc 0
10 mol 99 unq 1 iso 0 dist 5.33644 4.74654 5.17028 7.21001 11.1962 9.36749 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 6.13872 8.45395 9.80135 7.56512 8.03259 9.30874 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 6.13872 5.41368 4.97806 7.56512 8.03259 5.54873 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 9.52151 7.15624 10.277 6.28221 7.98941 9.69976 numMergedOcc 0
14 mol 219 unq 1 iso 0 dist 8.62654 7.15624 10.2112 6.28221 14.8072 9.69976 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 7.99525 7.79085 5.30261 15.5993 13.2151 8.94854 numMergedOcc 0
16 mol 232 unq 1 iso 0 dist 9.20965 6.48753 5.30261 12.3945 13.2151 8.94854 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.68803 5.66792 7.4709 4.53635 8.01565 6.31114 numMergedOcc 0
18 mol 269 unq 0 iso 0 dist 7.97206 5.98602 4.52168 5.4659 9.05472 8.63324 numMergedOcc 0
19 mol 269 unq 1 iso 0 dist 7.1068 9.78238 4.52168 11.927 9.05472 8.63324 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 8.26851 8.62431 4.05661 8.77987 7.24089 9.89613 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 8.14634 8.62431 7.47324 8.77987 10.0585 9.89613 numMergedOcc 0
