0 mol 8 unq 0 iso 0 dist 7.46102 8.16743 4.85329 3.69663 4.92734 7.77271 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.47227 8.16743 10.8135 3.69663 6.26138 7.77271 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.91301 8.16743 12.9498 3.69663 6.57999 7.77271 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 7.20538 7.23914 6.28202 6.31812 10.2288 9.33168 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 7.20538 7.23914 6.28202 8.39913 8.96238 7.93388 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.72689 6.98838 5.90098 7.17073 14.2584 9.0321 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 9.93555 8.46844 5.83431 7.19596 8.34737 9.39643 numMergedOcc 0
7 mol 159 unq 0 iso 0 dist 7.97007 8.94941 6.49376 5.21344 7.47975 6.68441 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 8.1088 9.56248 13.5291 16.1177 18.4541 9.13913 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 9.58911 8.45395 10.5753 7.56512 6.58792 9.30874 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.58911 5.41368 5.88819 7.56512 6.58792 5.54873 numMergedOcc 0
11 mol 219 unq 0 iso 0 dist 4.87446 7.15624 4.52622 6.28221 6.8424 9.69976 numMergedOcc 0
12 mol 219 unq 1 iso 0 dist 7.49235 7.15624 5.13707 6.28221 12.5982 9.69976 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 7.70279 9.61294 8.78722 5.18593 8.89211 6.37335 numMergedOcc 0
14 mol 232 unq 1 iso 0 dist 7.70279 9.61294 8.78722 11.7113 12.9697 8.66693 numMergedOcc 0
15 mol 232 unq 2 iso 0 dist 9.29752 9.61294 13.5597 5.18593 13.0468 6.37335 numMergedOcc 0
16 mol 232 unq 3 iso 0 dist 9.29752 9.61294 13.5597 11.7113 13.6896 8.66693 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 6.55855 8.62431 14.168 8.77987 13.1605 9.89613 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 9.52894 8.62431 17.7203 8.77987 16.9209 9.89613 numMergedOcc 0
