0 mol 48 unq 0 iso 0 dist 8.38139 8.06519 11.6226 7.99735 5.0573 13.3375 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 8.38139 7.54027 6.87877 7.99735 5.0573 8.95658 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.76314 8.80303 7.95192 6.25196 4.11549 10.4607 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 5.76314 8.80303 7.95192 8.88159 8.12687 15.5121 numMergedOcc 0
4 mol 54 unq 2 iso 0 dist 5.76314 5.59179 7.18196 6.25196 4.11549 6.36332 numMergedOcc 0
5 mol 54 unq 3 iso 0 dist 5.76314 5.59179 7.18196 8.88159 8.12687 4.66088 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 9.23164 9.99922 11.9578 7.85826 5.04832 10.7752 numMergedOcc 0
7 mol 65 unq 0 iso 0 dist 8.59587 8.48604 5.4269 9.71155 5.7105 9.52396 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.86236 8.67615 5.75693 8.96628 8.15449 12.0237 numMergedOcc 0
9 mol 132 unq 0 iso 0 dist 8.78382 9.57415 5.63272 9.20977 4.8602 4.88005 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 8.95504 8.36606 7.97595 7.36833 11.8638 10.5221 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 6.28379 8.25961 11.1021 9.46821 9.90504 13.7851 numMergedOcc 0
12 mol 233 unq 1 iso 0 dist 9.29279 8.25961 15.0846 9.46821 4.94129 13.7851 numMergedOcc 0
13 mol 280 unq 0 iso 0 dist 9.69573 7.11605 16.7025 8.71581 6.22294 15.4342 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 5.06731 8.85872 13.3584 4.75392 6.45653 12.0536 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 5.06731 8.85872 13.3584 8.61667 9.67944 13.7407 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 5.06731 8.85872 13.3584 4.75392 6.45653 12.0536 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 5.06731 8.85872 13.3584 8.61667 9.67944 13.7407 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 5.06731 8.85872 13.3584 4.75392 6.45653 12.0536 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 5.06731 8.85872 13.3584 8.61667 9.67944 13.7407 numMergedOcc 0
