0 mol 63 unq 0 iso 0 dist 8.23695 7.04212 9.37311 13.2176 9.00612 15.8107 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 5.8409 8.13368 3.93133 7.4829 8.48827 8.03895 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 5.8409 8.13368 3.93133 8.47947 7.14048 5.68873 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 8.13368 5.8409 3.93133 7.4829 8.03895 8.48827 numMergedOcc 0
4 mol 78 unq 3 iso 0 dist 8.13368 5.8409 3.93133 8.47947 5.68873 7.14048 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.79535 7.33521 15.5008 13.8801 8.56269 21.0792 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 9.79535 7.33521 15.5008 7.19267 9.40699 11.6378 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.31509 6.14782 4.24815 5.90092 9.68556 9.23905 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 6.31509 8.49806 4.66569 5.90092 9.68556 8.73928 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 8.49806 6.31509 4.66569 5.90092 8.73928 9.68556 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 8.49806 6.14782 6.55152 5.90092 8.73928 9.23905 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 8.80094 9.03681 17.0164 3.6038 8.47543 11.8548 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 7.7195 9.43988 15.8405 4.71092 7.06555 13.7097 numMergedOcc 0
13 mol 180 unq 0 iso 0 dist 8.65601 5.78414 10.0908 12.6752 6.91244 16.0267 numMergedOcc 0
14 mol 185 unq 0 iso 0 dist 9.27825 8.86187 5.81461 10.2953 9.1549 13.3509 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 6.50591 7.26569 4.5177 6.47265 7.45831 10.0507 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 9.6748 8.71177 8.87623 6.56644 6.46793 11.1891 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 4.76689 7.26455 5.43735 5.30931 7.88108 12.0301 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 4.76689 7.26455 5.43735 7.91474 9.46576 11.9193 numMergedOcc 0
