0 mol 11 unq 0 iso 0 dist 5.95165 6.50001 4.10106 5.51164 6.40513 9.33059 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.6396 5.77745 6.47509 16.5953 8.23292 14.1443 numMergedOcc 0
2 mol 35 unq 0 iso 0 dist 9.466 9.33969 7.01426 11.0391 9.8985 15.7391 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 6.4551 6.63973 6.77898 4.00834 4.83274 6.97936 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 6.4551 6.63973 6.77898 9.6911 7.89214 5.00466 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 9.65047 9.70292 14.2178 15.0981 9.40559 20.1016 numMergedOcc 0
6 mol 95 unq 1 iso 0 dist 9.65047 9.59704 8.78079 15.0981 9.40559 17.7481 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 4.99966 4.49975 4.65519 4.36597 7.55805 8.79764 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 7.95871 9.79864 9.62029 11.703 9.56867 18.1484 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 5.49877 5.82945 4.97996 7.43279 9.05626 9.67398 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 4.44292 7.25009 7.10286 7.64573 8.66709 5.55218 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 6.07091 6.51523 7.5383 5.24208 6.01711 9.67711 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.10287 5.06713 8.90569 7.47443 6.57849 10.2097 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 8.10287 8.69512 6.37317 7.47443 6.57849 5.63283 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 9.78438 8.79378 7.89575 5.59897 7.0119 10.7187 numMergedOcc 0
15 mol 212 unq 0 iso 0 dist 5.87223 5.03184 3.9436 10.1355 7.87125 10.7857 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.94315 7.13727 7.06793 15.8036 7.98022 14.5078 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 8.59074 8.56975 7.06793 12.1988 7.98022 14.5078 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 6.83408 9.13546 6.56539 4.93509 6.80096 10.2252 numMergedOcc 0
19 mol 264 unq 1 iso 0 dist 6.83408 8.7365 4.76241 4.93509 6.80096 10.7237 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 8.59986 6.22195 4.74189 6.31111 7.72749 4.93584 numMergedOcc 0
