0 mol 20 unq 0 iso 0 dist 7.67558 6.81416 6.44057 6.98731 11.3204 8.72023 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 5.11663 9.46333 4.54108 5.45587 4.82342 7.57959 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.81392 7.05867 8.1203 5.28824 12.5041 9.46994 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 6.33571 7.63006 10.3904 10.119 15.7939 8.16733 numMergedOcc 0
4 mol 94 unq 1 iso 0 dist 6.33571 7.63006 10.3904 6.26149 12.4139 9.97569 numMergedOcc 0
5 mol 209 unq 0 iso 0 dist 9.53736 6.43914 11.9096 5.35615 12.6457 8.41195 numMergedOcc 0
6 mol 229 unq 0 iso 0 dist 7.79058 7.09453 7.82856 9.84917 9.68636 8.92743 numMergedOcc 0
7 mol 229 unq 1 iso 0 dist 7.79058 7.09453 7.82856 6.89 11.9241 8.08082 numMergedOcc 0
8 mol 229 unq 2 iso 0 dist 7.79058 7.09453 7.82856 9.68525 11.9461 5.77318 numMergedOcc 0
9 mol 229 unq 3 iso 0 dist 7.79058 7.09453 7.82856 10.7618 14.9867 8.19603 numMergedOcc 0
10 mol 230 unq 0 iso 0 dist 6.27573 6.47064 8.54313 10.7614 10.9159 9.09271 numMergedOcc 0
11 mol 230 unq 1 iso 0 dist 6.27573 6.47064 8.54313 11.777 13.3702 7.44838 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 8.01588 8.74485 6.23328 6.80725 12.1129 8.67805 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 8.19911 9.45457 6.64602 9.00146 11.0373 6.86945 numMergedOcc 0
14 mol 252 unq 1 iso 0 dist 7.24226 9.44744 6.44909 11.8815 10.1414 6.11473 numMergedOcc 0
15 mol 252 unq 2 iso 0 dist 7.24226 6.94319 5.04047 11.8815 10.1414 8.47784 numMergedOcc 0
16 mol 252 unq 3 iso 0 dist 7.24226 6.94319 5.04047 5.29359 11.4105 8.66469 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.7833 8.43941 6.08746 9.88911 13.0578 9.53063 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 5.21387 9.91954 7.02897 15.213 13.6132 7.52281 numMergedOcc 0
19 mol 264 unq 1 iso 0 dist 5.21387 9.91954 7.02897 7.50444 6.66602 6.42588 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 8.33893 9.03362 4.49854 12.6489 6.23184 7.67245 numMergedOcc 0
21 mol 278 unq 1 iso 0 dist 8.33893 9.03362 4.49854 14.7348 10.2998 9.12395 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 8.79534 5.78275 6.89875 9.13951 5.71661 7.91611 numMergedOcc 0
