0 mol 34 unq 0 iso 0 dist 6.20159 8.8717 4.77186 6.87212 6.44363 9.69215 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 5.94787 7.05867 5.69805 6.99148 7.9399 7.34678 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 7.82214 8.82052 6.47761 12.1057 9.27456 13.2601 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 5.27549 8.51585 4.80028 12.7434 9.13829 9.89576 numMergedOcc 0
4 mol 120 unq 1 iso 0 dist 5.27549 8.51585 4.80028 8.14582 5.90276 9.07172 numMergedOcc 0
5 mol 120 unq 2 iso 0 dist 5.27549 8.51585 4.80028 9.2673 8.565 12.5083 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 5.7306 6.03116 3.44683 13.0181 9.19804 11.7023 numMergedOcc 0
7 mol 163 unq 0 iso 0 dist 5.43385 8.74174 5.57459 9.44058 6.54995 6.0247 numMergedOcc 0
8 mol 163 unq 1 iso 0 dist 5.43385 8.74174 5.57459 5.51241 5.27374 6.40873 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 7.71402 6.6276 8.73305 4.88159 6.00793 9.17387 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 8.88235 6.87058 5.2303 5.37948 7.56376 4.94811 numMergedOcc 0
11 mol 237 unq 0 iso 0 dist 9.81108 9.57858 9.59218 7.63505 7.11512 12.7761 numMergedOcc 0
12 mol 237 unq 1 iso 0 dist 9.81108 6.96229 4.83024 7.63505 7.11512 8.06435 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 9.95473 8.43941 3.42387 5.17102 8.4485 8.15795 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 5.15737 8.39358 7.24378 5.76227 7.01175 11.3041 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 5.15737 8.39358 7.24378 5.29294 7.50074 6.64472 numMergedOcc 0
