0 mol 11 unq 0 iso 0 dist 8.15498 4.95723 9.3651 8.14604 9.81247 5.67296 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.13662 9.54175 9.3651 4.92562 9.81247 5.67296 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 6.77845 6.83996 9.3651 6.02745 9.81247 5.67296 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 7.489 6.74356 7.7568 7.01354 6.69711 9.08524 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 9.16551 8.1394 7.85573 8.39078 9.4798 11.6488 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.16558 5.23343 6.23298 4.39526 5.70192 5.52457 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 9.62459 5.23343 9.85405 4.39526 7.65646 5.52457 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 9.97991 9.2036 8.43093 6.1572 6.94997 5.04401 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 7.28774 7.05715 5.33644 4.54208 4.74654 5.17028 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 5.36955 4.65265 5.43052 5.59478 9.29817 5.17209 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 5.70772 4.93601 5.82034 6.73253 9.8769 4.96701 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 5.03663 6.64765 5.82034 7.99241 9.8769 4.96701 numMergedOcc 0
12 mol 147 unq 2 iso 0 dist 8.93916 12.1565 5.82034 13.0045 9.8769 4.96701 numMergedOcc 0
13 mol 151 unq 0 iso 0 dist 8.25396 9.10018 9.74969 8.92422 8.00027 4.18547 numMergedOcc 0
14 mol 183 unq 0 iso 0 dist 8.53483 5.85166 5.83335 6.93732 7.42108 6.39381 numMergedOcc 0
15 mol 183 unq 1 iso 0 dist 8.53483 18.0876 9.92635 6.93732 7.42108 16.8061 numMergedOcc 0
16 mol 183 unq 2 iso 0 dist 8.58404 5.78444 5.83335 12.0539 7.42108 6.39381 numMergedOcc 0
17 mol 183 unq 3 iso 0 dist 8.58404 13.2035 9.92635 12.0539 7.42108 16.8061 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.6011 12.1847 9.86348 13.185 8.72538 8.96075 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 8.61953 4.31461 6.50727 7.69844 8.32685 5.92782 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 7.91999 4.31461 7.84826 7.69844 6.74777 5.92782 numMergedOcc 0
21 mol 269 unq 0 iso 0 dist 9.48928 5.57188 7.1068 6.45659 9.78238 4.52168 numMergedOcc 0
