0 mol 54 unq 0 iso 0 dist 6.22124 6.94712 10.0644 5.99498 9.11686 12.7971 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.76828 5.91019 12.6319 12.1862 5.14178 14.6352 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 6.86975 9.08834 5.34502 5.47271 6.96576 11.0294 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 9.9387 6.62354 11.0597 12.754 9.08671 17.3273 numMergedOcc 0
4 mol 128 unq 0 iso 0 dist 7.90691 6.6014 9.92243 8.39388 7.50206 13.1793 numMergedOcc 0
5 mol 128 unq 1 iso 0 dist 8.83011 6.6014 9.96803 8.39388 6.4028 13.1793 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 7.87557 9.77227 3.94875 5.48499 9.02432 12.4007 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 6.03116 8.59532 9.30554 10.3386 6.31314 15.075 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 7.87322 8.46046 10.7636 5.43254 4.0037 6.95244 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 7.87322 7.48065 9.14584 5.43254 4.0037 6.11224 numMergedOcc 0
10 mol 188 unq 0 iso 0 dist 8.14959 8.01604 8.18087 12.4412 8.8513 16.1731 numMergedOcc 0
11 mol 188 unq 1 iso 0 dist 8.14959 8.01604 8.18087 16.3941 9.53031 15.7273 numMergedOcc 0
12 mol 188 unq 2 iso 0 dist 8.14959 9.07006 5.51589 12.4412 8.8513 13.9851 numMergedOcc 0
13 mol 188 unq 3 iso 0 dist 8.14959 9.07006 5.51589 16.3941 9.53031 12.5283 numMergedOcc 0
14 mol 188 unq 4 iso 0 dist 5.36962 7.03264 8.18087 9.99324 8.8513 16.1731 numMergedOcc 0
15 mol 188 unq 5 iso 0 dist 5.36962 7.03264 8.18087 11.2733 9.53031 15.7273 numMergedOcc 0
16 mol 188 unq 6 iso 0 dist 5.36962 6.32826 5.51589 9.99324 8.8513 13.9851 numMergedOcc 0
17 mol 188 unq 7 iso 0 dist 5.36962 6.32826 5.51589 11.2733 9.53031 12.5283 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 8.22643 8.08491 9.48862 8.61846 5.46768 13.1403 numMergedOcc 0
19 mol 207 unq 0 iso 0 dist 5.86317 7.25953 5.47626 5.47226 7.21449 11.2629 numMergedOcc 0
20 mol 207 unq 1 iso 0 dist 5.86317 7.25953 5.47626 10.8177 9.22778 14.6198 numMergedOcc 0
21 mol 207 unq 2 iso 0 dist 5.86317 9.05688 7.64813 5.47226 7.21449 13.049 numMergedOcc 0
22 mol 207 unq 3 iso 0 dist 5.86317 9.05688 7.64813 10.8177 9.22778 15.4025 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 9.11795 5.56977 5.52297 8.09631 7.49436 8.89981 numMergedOcc 0
