0 mol 129 unq 0 iso 0 dist 5.57004 4.47453 5.16531 7.3881 7.04904 4.39633 numMergedOcc 0
1 mol 129 unq 1 iso 0 dist 5.57004 4.47453 5.16531 5.1956 5.06053 4.13875 numMergedOcc 0
2 mol 154 unq 0 iso 0 dist 9.46694 7.07599 9.87968 5.19527 8.44389 10.9822 numMergedOcc 0
3 mol 169 unq 0 iso 0 dist 6.1091 9.01071 6.09291 5.79743 7.50458 10.1931 numMergedOcc 0
4 mol 169 unq 1 iso 0 dist 6.1091 9.01071 6.09291 7.98467 5.79554 10.5136 numMergedOcc 0
5 mol 169 unq 2 iso 0 dist 6.1091 9.01071 6.09291 7.33201 4.22003 10.212 numMergedOcc 0
6 mol 192 unq 0 iso 0 dist 9.36087 5.74406 5.21088 5.1472 5.05414 3.9335 numMergedOcc 0
7 mol 192 unq 1 iso 0 dist 9.36087 5.74406 5.21088 8.26223 7.16964 5.31881 numMergedOcc 0
8 mol 192 unq 2 iso 0 dist 9.36087 15.3055 9.78743 5.1472 5.05414 10.6325 numMergedOcc 0
9 mol 192 unq 3 iso 0 dist 9.36087 15.3055 9.78743 8.26223 7.16964 7.64178 numMergedOcc 0
10 mol 192 unq 4 iso 0 dist 9.36087 11.3171 8.25609 5.1472 5.05414 10.6087 numMergedOcc 0
11 mol 192 unq 5 iso 0 dist 9.36087 11.3171 8.25609 8.26223 7.16964 13.6786 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 7.70514 6.41781 9.85777 5.65704 8.93485 10.5366 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 7.70514 10.5614 8.47833 5.65704 8.93485 6.82382 numMergedOcc 0
14 mol 205 unq 2 iso 0 dist 7.70514 8.2132 5.05912 5.65704 8.93485 9.27501 numMergedOcc 0
15 mol 205 unq 3 iso 0 dist 7.2139 10.5614 5.47586 5.65704 5.66636 6.82382 numMergedOcc 0
16 mol 205 unq 4 iso 0 dist 7.2139 8.2132 6.60429 5.65704 5.66636 9.27501 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 8.69531 10.6739 5.70065 8.93032 9.49242 5.81094 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 8.69531 10.6739 5.70065 16.7385 9.25184 6.59517 numMergedOcc 0
19 mol 210 unq 2 iso 0 dist 9.8306 12.4863 5.70065 11.1653 9.49242 5.81094 numMergedOcc 0
20 mol 210 unq 3 iso 0 dist 9.8306 12.4863 5.70065 18.2977 9.25184 6.59517 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 7.51866 11.148 6.94194 3.95367 8.69334 10.4402 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 6.47223 6.98695 7.38536 5.62003 5.28731 3.57803 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 5.97806 10.5921 7.38536 9.20863 5.28731 3.57803 numMergedOcc 0
24 mol 285 unq 2 iso 0 dist 8.21971 5.03496 7.38536 5.82428 5.28731 3.57803 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 4.66426 4.93194 6.19545 4.72104 6.16127 4.00861 numMergedOcc 0
26 mol 287 unq 1 iso 0 dist 4.66426 4.6336 7.3388 4.72104 6.16127 5.03775 numMergedOcc 0
27 mol 287 unq 2 iso 0 dist 4.66426 4.25767 6.96248 4.72104 6.16127 8.95194 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 4.66426 4.93194 6.19545 4.72104 6.16127 4.00861 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 4.66426 4.6336 7.3388 4.72104 6.16127 5.03775 numMergedOcc 0
30 mol 288 unq 2 iso 0 dist 4.66426 4.25767 6.96248 4.72104 6.16127 8.95194 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 4.66426 4.93194 6.19545 4.72104 6.16127 4.00861 numMergedOcc 0
32 mol 289 unq 1 iso 0 dist 4.66426 4.6336 7.3388 4.72104 6.16127 5.03775 numMergedOcc 0
33 mol 289 unq 2 iso 0 dist 4.66426 4.25767 6.96248 4.72104 6.16127 8.95194 numMergedOcc 0
