0 mol 98 unq 0 iso 0 dist 9.17137 5.13015 7.56041 12.602 5.88354 12.1948 numMergedOcc 0
1 mol 98 unq 1 iso 0 dist 9.17137 5.13015 7.56041 14.9745 7.89665 13.2435 numMergedOcc 0
2 mol 98 unq 2 iso 0 dist 9.17137 5.13015 7.56041 6.80307 5.39354 5.62353 numMergedOcc 0
3 mol 98 unq 3 iso 0 dist 9.17137 5.13015 7.56041 5.37332 5.74854 7.42934 numMergedOcc 0
4 mol 98 unq 4 iso 0 dist 9.17137 5.13015 7.56041 12.921 8.76566 8.99607 numMergedOcc 0
5 mol 98 unq 5 iso 0 dist 9.17137 5.13015 7.56041 10.4811 8.8368 5.36136 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 5.9819 14.1105 9.67948 4.9102 6.43433 11.4909 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 5.9819 14.1105 9.67948 6.84034 9.92283 13.1737 numMergedOcc 0
8 mol 112 unq 2 iso 0 dist 5.9819 12.1557 6.55773 4.9102 6.43433 10.3209 numMergedOcc 0
9 mol 112 unq 3 iso 0 dist 5.9819 12.1557 6.55773 6.84034 9.92283 13.9635 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 9.08064 12.611 7.83401 8.14279 8.56003 6.89903 numMergedOcc 0
11 mol 189 unq 0 iso 0 dist 9.5853 10.5365 5.15305 5.56399 8.56355 6.67182 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 9.88251 10.3459 8.01082 14.4147 8.44861 4.87114 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 9.88251 10.3459 8.01082 13.9684 5.60393 9.43922 numMergedOcc 0
14 mol 230 unq 0 iso 0 dist 6.47064 14.558 9.03723 10.7614 9.09271 11.958 numMergedOcc 0
15 mol 230 unq 1 iso 0 dist 6.47064 14.558 9.03723 11.777 7.44838 6.49467 numMergedOcc 0
16 mol 252 unq 0 iso 0 dist 9.44744 10.7442 9.00798 11.8815 6.11473 6.57025 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 5.67349 5.79529 9.39571 4.63237 5.26434 6.42225 numMergedOcc 0
18 mol 261 unq 1 iso 0 dist 5.67349 5.79529 9.39571 6.39263 8.60026 11.0363 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 9.03362 9.25629 6.06813 12.6489 7.67245 9.61803 numMergedOcc 0
20 mol 278 unq 1 iso 0 dist 9.03362 9.25629 6.06813 14.7348 9.12395 7.87608 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 5.78275 12.1248 9.99345 9.13951 7.91611 14.8586 numMergedOcc 0
