0 mol 46 unq 0 iso 0 dist 8.78474 10.1207 8.16059 4.81634 5.2568 5.83277 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 8.24314 6.02415 8.16059 6.99019 5.2568 5.83277 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.54374 9.06972 6.95094 9.33289 8.14547 6.35914 numMergedOcc 0
3 mol 142 unq 0 iso 0 dist 9.67785 9.52963 5.1557 10.121 5.79144 6.61855 numMergedOcc 0
4 mol 142 unq 1 iso 0 dist 9.67785 9.81398 9.5355 10.121 5.79144 5.19808 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 8.64606 7.83675 4.95086 4.8693 8.62135 5.14383 numMergedOcc 0
6 mol 147 unq 1 iso 0 dist 8.64606 14.9083 8.39524 4.8693 8.62135 14.0428 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 8.36552 10.3157 7.02608 14.8711 7.69241 11.5221 numMergedOcc 0
8 mol 176 unq 1 iso 0 dist 8.36552 10.3157 7.02608 7.56198 8.56192 5.5435 numMergedOcc 0
9 mol 176 unq 2 iso 0 dist 8.36552 10.3157 7.02608 9.21051 7.77962 10.9534 numMergedOcc 0
10 mol 176 unq 3 iso 0 dist 8.36552 10.3157 7.02608 12.8657 8.6431 12.9083 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 9.84306 19.3099 9.81282 9.50462 8.58178 13.7825 numMergedOcc 0
12 mol 183 unq 1 iso 0 dist 9.84306 19.3099 9.81282 10.3782 4.77438 9.83347 numMergedOcc 0
13 mol 183 unq 2 iso 0 dist 9.84306 19.3099 9.81282 14.7123 5.73344 5.14341 numMergedOcc 0
14 mol 185 unq 0 iso 0 dist 8.93886 10.3636 6.11382 6.31855 4.91046 4.96002 numMergedOcc 0
15 mol 199 unq 0 iso 0 dist 6.33787 5.47687 7.29716 4.09813 9.2815 6.58405 numMergedOcc 0
16 mol 211 unq 0 iso 0 dist 7.79873 10.088 9.45365 4.80737 8.13147 11.3775 numMergedOcc 0
17 mol 211 unq 1 iso 0 dist 7.79873 5.6174 7.15386 4.80737 8.13147 6.72244 numMergedOcc 0
18 mol 211 unq 2 iso 0 dist 7.79873 4.00712 7.73993 4.80737 8.13147 8.28079 numMergedOcc 0
19 mol 231 unq 0 iso 0 dist 7.88488 6.57285 8.63896 4.16638 8.27156 6.09153 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 7.50445 5.40449 8.8978 6.55971 8.33309 8.41106 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 7.96566 4.91015 7.98871 9.2069 9.98309 4.88613 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 8.25521 5.43755 8.78148 5.78964 8.26827 3.46565 numMergedOcc 0
