0 mol 32 unq 0 iso 0 dist 4.31912 9.16481 6.49199 7.70136 7.18766 9.65897 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.23162 7.61802 10.7745 6.68767 11.9657 5.91068 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 6.57908 7.61802 4.22398 6.68767 8.55901 5.91068 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 6.31824 8.87762 4.53851 15.2801 11.3894 7.79336 numMergedOcc 0
4 mol 34 unq 3 iso 0 dist 6.31824 8.21762 5.31195 15.2801 11.3894 7.08559 numMergedOcc 0
5 mol 34 unq 4 iso 0 dist 6.31824 8.21762 5.31195 9.63453 12.1859 8.63635 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 7.44647 5.90605 4.39545 5.25762 6.65776 5.28732 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 5.76702 6.31404 6.37052 5.93604 8.55681 4.26972 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 5.76702 6.31404 6.37052 6.50711 11.0104 7.54341 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 4.90724 6.20862 3.92979 6.299 8.75834 8.91356 numMergedOcc 0
10 mol 225 unq 1 iso 0 dist 4.90724 6.20862 3.92979 9.63082 9.36396 9.59574 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 9.38859 7.86214 9.59241 6.99665 9.2911 6.01775 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 5.99388 4.37501 6.00588 5.04225 8.49841 8.27411 numMergedOcc 0
13 mol 234 unq 1 iso 0 dist 5.99388 4.37501 6.00588 6.99882 10.0446 7.36208 numMergedOcc 0
14 mol 243 unq 0 iso 0 dist 9.8043 5.91328 10.106 5.32118 9.1101 9.33476 numMergedOcc 0
15 mol 248 unq 0 iso 0 dist 8.33529 6.79869 6.71098 4.50926 12.061 8.07962 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 8.76664 8.52702 5.63077 4.91827 9.72517 8.5613 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 8.76664 8.52702 5.63077 8.29529 9.97652 5.7791 numMergedOcc 0
18 mol 260 unq 2 iso 0 dist 9.00987 8.52702 12.2431 4.91827 13.4375 8.5613 numMergedOcc 0
19 mol 260 unq 3 iso 0 dist 9.00987 8.52702 12.2431 8.29529 14.0525 5.7791 numMergedOcc 0
20 mol 270 unq 0 iso 0 dist 9.4555 9.34963 4.4142 9.0548 6.79822 9.04189 numMergedOcc 0
21 mol 270 unq 1 iso 0 dist 9.94203 9.6012 3.98629 6.83592 9.17227 9.51462 numMergedOcc 0
22 mol 283 unq 0 iso 0 dist 9.41532 5.31969 6.3713 4.50624 13.5551 8.51504 numMergedOcc 0
