0 mol 8 unq 0 iso 0 dist 9.36227 7.46102 8.79328 4.81384 13.2172 8.33604 8.16743 12.0906 4.85329 6.26865 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 4.67917 6.65344 5.34079 10.4897 11.5407 6.71911 10.6421 9.94975 5.3525 6.5096 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 6.88924 6.65344 6.11334 10.4897 12.4004 6.71911 10.6421 8.70612 5.3525 6.5096 numMergedOcc 0
3 mol 127 unq 0 iso 0 dist 9.16999 9.42513 4.70935 10.2034 12.3265 9.81878 16.2351 16.4612 14.085 6.3244 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 7.12336 5.86531 5.37072 5.80615 11.5756 7.92688 10.7899 15.7698 11.8989 9.94276 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 7.12336 5.86531 5.37072 5.80615 11.5756 7.92688 11.5344 18.3973 15.0734 9.05357 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 7.12336 5.86531 5.37072 5.80615 11.5756 7.92688 9.98051 14.6256 9.58627 5.99299 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 6.91762 4.44292 5.01007 4.40049 8.02593 7.39644 7.62575 5.92486 5.40375 7.37901 numMergedOcc 0
8 mol 187 unq 0 iso 0 dist 7.81168 9.36086 12.368 5.94354 13.5882 9.27478 8.26654 13.0397 6.62321 7.01496 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 8.61427 7.73315 9.20709 12.9902 17.5662 8.53199 12.023 14.6639 7.47048 6.75035 numMergedOcc 0
10 mol 234 unq 0 iso 0 dist 7.50665 7.50424 5.44171 13.0543 10.881 6.16063 10.6033 8.96694 5.9221 8.49841 numMergedOcc 0
11 mol 235 unq 0 iso 0 dist 8.92054 8.48065 6.84447 5.52698 8.19915 8.21247 10.648 5.85485 10.6981 7.27958 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 7.82564 9.66555 5.60375 8.92175 9.57914 7.49471 13.4351 13.0115 12.1252 6.17025 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 9.51177 9.66555 10.42 8.92175 12.4083 7.49471 13.4351 14.0686 12.1252 6.17025 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 9.91136 8.67205 5.60375 5.94371 9.57914 7.49471 11.5848 13.0115 12.1252 6.17025 numMergedOcc 0
