0 mol 8 unq 0 iso 0 dist 8.73998 8.37509 15.5539 16.3437 9.59644 24.3488 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 7.30392 9.11976 14.7238 3.91116 6.35789 12.6981 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 8.70106 6.13194 13.5214 10.6064 7.52954 15.1442 numMergedOcc 0
3 mol 104 unq 0 iso 0 dist 8.44593 7.43351 10.4022 5.66064 8.44663 10.7079 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 8.54701 8.91758 6.16644 7.72465 9.00829 5.28955 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 5.68879 6.61966 5.7998 4.85533 9.34752 6.67306 numMergedOcc 0
6 mol 119 unq 2 iso 0 dist 5.68879 6.61966 5.7998 8.93999 8.41858 13.587 numMergedOcc 0
7 mol 124 unq 0 iso 0 dist 6.31232 9.69841 11.0785 6.70976 9.7589 15.7478 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.95717 6.30762 4.1643 9.30741 9.09918 8.89412 numMergedOcc 0
9 mol 132 unq 0 iso 0 dist 9.10144 9.7097 5.6296 8.65247 7.16287 10.0721 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 4.46578 6.90904 6.63023 6.53566 5.9962 9.63488 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 4.46578 6.90904 6.63023 4.77272 8.61448 9.31907 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.98221 9.11273 4.96821 10.7102 5.83898 9.01869 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 7.6174 6.93858 11.8711 13.1272 7.54614 18.5517 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 4.70107 8.78029 10.4744 5.23612 8.04934 13.3114 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 4.70107 8.78029 10.4744 6.41922 5.9919 10.7828 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 9.73318 8.95513 11.7643 12.8213 5.43868 14.6446 numMergedOcc 0
17 mol 250 unq 1 iso 0 dist 5.75551 8.95513 5.64152 12.8213 9.80833 14.6446 numMergedOcc 0
18 mol 293 unq 0 iso 0 dist 6.02106 9.50932 6.64058 4.35498 7.67909 12.3525 numMergedOcc 0
19 mol 293 unq 1 iso 0 dist 8.27274 9.50932 10.2071 4.35498 6.83404 12.3525 numMergedOcc 0
