0 mol 8 unq 0 iso 0 dist 6.96907 9.08552 7.38068 13.7837 15.1676 9.01112 17.5887 15.9465 9.29802 7.45487 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.15471 9.45103 5.7598 12.5048 12.8949 8.43054 13.7748 9.93528 6.04677 5.84479 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 9.94735 5.62688 8.68463 5.02731 14.9027 9.2898 11.3844 20.5973 14.8094 6.80741 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 9.44388 5.62688 10.5328 5.02731 12.1419 9.2898 11.3844 15.0849 14.8094 6.80741 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 5.37449 8.8326 5.34337 15.957 12.6902 8.13108 11.0633 6.77576 4.74638 6.83992 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.52666 8.8326 10.8827 15.957 14.7622 8.13108 11.0633 8.55489 4.74638 6.83992 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.26325 8.46972 9.14454 10.1294 13.7657 5.51197 12.6621 13.1838 4.79473 6.29026 numMergedOcc 0
7 mol 142 unq 0 iso 0 dist 7.21779 5.90339 4.65943 8.68855 10.1001 7.81207 9.5355 7.46089 9.23267 7.57458 numMergedOcc 0
8 mol 224 unq 0 iso 0 dist 5.07376 5.88041 4.67513 13.1803 12.6229 8.08349 7.46044 4.49347 3.56689 9.75313 numMergedOcc 0
9 mol 224 unq 1 iso 0 dist 5.07376 5.88041 4.67513 13.1803 12.6229 8.08349 17.2648 14.9838 11.4272 6.08709 numMergedOcc 0
10 mol 224 unq 2 iso 0 dist 8.18749 5.31916 5.81697 9.81806 14.526 8.79428 15.0577 16.2447 12.65 9.79616 numMergedOcc 0
11 mol 224 unq 3 iso 0 dist 8.18749 5.31916 5.81697 5.99647 10.0508 6.8692 13.2758 11.711 9.56183 9.29703 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 7.30003 6.50932 3.89748 8.38435 8.69551 5.1823 7.52696 4.81997 5.39025 7.2346 numMergedOcc 0
13 mol 264 unq 0 iso 0 dist 7.27155 7.05095 4.77242 9.80039 8.91251 5.90058 15.1151 11.1442 8.41904 7.22789 numMergedOcc 0
14 mol 280 unq 0 iso 0 dist 6.38295 6.16546 4.06908 5.80223 7.96485 6.86234 9.9227 11.4101 7.42656 8.85762 numMergedOcc 0
