0 mol 1 unq 0 iso 0 dist 9.19543 8.70365 8.18355 6.24156 12.1117 9.00146 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.19543 8.70365 8.18355 9.92098 4.75683 4.34875 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 9.19543 9.33719 4.34307 6.24156 12.1117 13.2651 numMergedOcc 0
3 mol 1 unq 3 iso 0 dist 9.19543 9.33719 4.34307 9.92098 4.75683 8.99175 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.31362 4.52881 8.1394 6.86391 5.02755 9.37301 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 6.47185 7.06922 7.00296 9.72136 13.7886 9.59822 numMergedOcc 0
6 mol 46 unq 1 iso 0 dist 6.47185 7.06922 7.00296 4.61355 8.70524 10.3583 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.69386 9.11976 12.4156 5.92285 6.44497 7.80474 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 6.69386 9.11976 12.4156 8.38687 13.6782 6.57724 numMergedOcc 0
9 mol 62 unq 2 iso 0 dist 9.09269 9.11976 9.42457 5.92285 8.03921 7.80474 numMergedOcc 0
10 mol 62 unq 3 iso 0 dist 9.09269 9.11976 9.42457 8.38687 3.83635 6.57724 numMergedOcc 0
11 mol 83 unq 0 iso 0 dist 9.54935 6.21251 11.084 6.61587 5.03778 9.23738 numMergedOcc 0
12 mol 83 unq 1 iso 0 dist 9.54935 6.21251 11.084 8.24464 8.54787 6.27705 numMergedOcc 0
13 mol 103 unq 0 iso 0 dist 9.66944 6.13194 14.9897 9.43076 4.3208 13.3309 numMergedOcc 0
14 mol 110 unq 0 iso 0 dist 8.74224 9.35378 5.84646 8.27843 5.35918 4.34447 numMergedOcc 0
15 mol 110 unq 1 iso 0 dist 5.33139 9.35378 6.69022 8.27843 4.10689 4.34447 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 5.79795 8.65373 10.0936 8.74572 3.93042 10.8438 numMergedOcc 0
17 mol 178 unq 1 iso 0 dist 5.79795 8.65373 10.0936 8.62441 3.95924 9.91243 numMergedOcc 0
18 mol 178 unq 2 iso 0 dist 5.79795 8.6561 10.6425 8.74572 3.93042 12.8704 numMergedOcc 0
19 mol 178 unq 3 iso 0 dist 5.79795 8.6561 10.6425 8.62441 3.95924 9.95083 numMergedOcc 0
20 mol 178 unq 4 iso 0 dist 5.79795 9.1197 11.9332 8.74572 3.93042 15.8477 numMergedOcc 0
21 mol 178 unq 5 iso 0 dist 5.79795 9.1197 11.9332 8.62441 3.95924 13.1405 numMergedOcc 0
22 mol 182 unq 0 iso 0 dist 8.86262 5.16184 6.91511 8.45614 4.66231 9.16709 numMergedOcc 0
23 mol 182 unq 1 iso 0 dist 7.23874 5.16184 4.98443 8.45614 9.47983 9.16709 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 9.24248 7.70035 11.3996 6.112 9.15328 4.76899 numMergedOcc 0
25 mol 255 unq 0 iso 0 dist 5.83014 5.17191 4.80227 8.08403 4.04928 6.11384 numMergedOcc 0
26 mol 282 unq 0 iso 0 dist 8.07221 9.40138 16.1355 9.07173 10.3404 10.3259 numMergedOcc 0
27 mol 282 unq 1 iso 0 dist 8.07221 8.37963 5.14293 9.07173 10.3404 14.1943 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 7.41633 9.86647 5.61341 6.52085 11.6034 13.0872 numMergedOcc 0
29 mol 284 unq 1 iso 0 dist 7.41633 9.86647 5.61341 9.84174 14.3977 12.4311 numMergedOcc 0
30 mol 284 unq 2 iso 0 dist 5.52837 9.86647 5.28356 6.52085 8.17165 13.0872 numMergedOcc 0
31 mol 284 unq 3 iso 0 dist 5.52837 9.86647 5.28356 9.84174 11.148 12.4311 numMergedOcc 0
32 mol 284 unq 4 iso 0 dist 6.73163 9.86647 9.83494 6.52085 4.03077 13.0872 numMergedOcc 0
33 mol 284 unq 5 iso 0 dist 6.73163 9.86647 9.83494 9.84174 11.131 12.4311 numMergedOcc 0
