0 mol 6 unq 0 iso 0 dist 8.63596 10.657 6.98764 7.85935 9.00426 7.29104 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 7.53599 14.0926 8.45034 8.10407 8.81141 12.221 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 5.94787 6.99148 7.9399 5.19616 9.64488 11.9965 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.88238 6.61758 9.57191 7.65955 5.64989 5.6721 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.82214 12.1057 9.27456 11.5334 6.00564 4.39271 numMergedOcc 0
5 mol 107 unq 0 iso 0 dist 7.20322 9.29034 8.83855 9.37086 6.93417 11.0367 numMergedOcc 0
6 mol 107 unq 1 iso 0 dist 7.20322 9.29034 8.83855 6.04612 6.36246 3.85355 numMergedOcc 0
7 mol 108 unq 0 iso 0 dist 8.92611 6.75729 6.23711 15.906 9.54994 9.46026 numMergedOcc 0
8 mol 108 unq 1 iso 0 dist 5.64136 4.89603 6.23711 5.65462 9.54994 9.46026 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 5.27549 12.7434 9.13829 12.7231 9.32166 5.1682 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 5.27549 8.14582 5.90276 12.7231 9.32166 8.25036 numMergedOcc 0
11 mol 120 unq 2 iso 0 dist 5.27549 9.2673 8.565 12.7231 9.32166 17.4169 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 5.7306 13.0181 9.19804 8.65195 6.61386 4.89133 numMergedOcc 0
13 mol 163 unq 0 iso 0 dist 5.43385 9.44058 6.54995 12.5106 7.27002 6.56076 numMergedOcc 0
14 mol 163 unq 1 iso 0 dist 5.43385 5.51241 5.27374 12.5106 7.27002 9.55758 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.254 5.82036 9.67328 9.91251 8.24405 9.70781 numMergedOcc 0
16 mol 237 unq 0 iso 0 dist 9.81108 7.63505 7.11512 10.205 8.32964 6.68355 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.95473 5.17102 8.4485 5.00301 8.65191 4.88527 numMergedOcc 0
