0 mol 29 unq 0 iso 0 dist 7.77822 8.00338 6.65851 9.70457 12.2129 5.99655 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.77613 7.32472 5.29955 4.33564 6.887 6.52283 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.75432 5.23167 3.70802 7.42892 10.623 7.16844 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.45469 5.23167 3.66673 7.42892 8.09973 7.16844 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 7.63855 6.0827 4.29679 5.06459 11.3849 8.93807 numMergedOcc 0
5 mol 62 unq 3 iso 0 dist 5.48766 6.0827 8.07308 5.06459 10.3746 8.93807 numMergedOcc 0
6 mol 62 unq 4 iso 0 dist 9.63139 6.0827 10.3525 5.06459 13.6914 8.93807 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 6.80165 7.94697 5.53904 8.57407 11.3993 8.96045 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 6.24764 7.61514 3.81285 10.6609 6.24296 4.29937 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 6.24764 7.61514 3.81285 11.2518 6.83218 3.65628 numMergedOcc 0
10 mol 85 unq 2 iso 0 dist 6.24764 7.61514 3.81285 13.5746 10.9154 9.77774 numMergedOcc 0
11 mol 85 unq 3 iso 0 dist 6.24764 8.21116 6.17121 10.6609 6.24296 5.37869 numMergedOcc 0
12 mol 85 unq 4 iso 0 dist 6.24764 8.21116 6.17121 11.2518 6.83218 4.05415 numMergedOcc 0
13 mol 85 unq 5 iso 0 dist 6.24764 8.21116 6.17121 13.5746 10.9154 9.97944 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 9.16474 6.38269 9.30891 7.6316 15.5302 8.67025 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 9.16474 7.11196 7.62615 12.7927 16.3591 9.60127 numMergedOcc 0
16 mol 169 unq 0 iso 0 dist 9.28392 6.18165 13.6106 14.017 22.2901 8.6961 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 6.14231 8.26228 7.71002 4.66338 9.93738 9.87744 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.62338 7.96707 3.76412 14.1553 9.98518 8.06767 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 8.62338 7.96707 3.76412 4.60276 10.8038 9.91087 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.62338 7.96707 3.76412 14.1553 9.98518 8.06767 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 8.62338 7.96707 3.76412 4.60276 10.8038 9.91087 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 8.62338 7.96707 3.76412 14.1553 9.98518 8.06767 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 8.62338 7.96707 3.76412 4.60276 10.8038 9.91087 numMergedOcc 0
