0 mol 8 unq 0 iso 0 dist 4.92734 9.91124 7.3915 7.97177 8.53529 5.65816 16.8935 14.1378 8.77457 11.3039 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.16444 6.84888 7.05346 5.86578 7.32257 8.88528 10.26 8.50424 8.076 7.35972 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.96238 6.5705 6.77886 4.936 7.16773 8.25666 13.2748 10.0962 6.99108 14.7378 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 8.05602 14.9908 7.26086 11.0132 6.65501 11.2092 13.251 7.06961 8.43352 6.88901 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 7.00285 10.8678 5.88354 4.81103 5.59328 8.53212 6.04768 4.67519 6.62972 7.14031 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 8.02354 13.5865 5.88354 7.22196 5.59328 8.53212 9.40173 4.67519 6.62972 7.14031 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 8.92577 7.04774 7.12017 5.48646 7.38135 9.38256 15.3732 9.75737 9.5669 14.4785 numMergedOcc 0
7 mol 100 unq 1 iso 0 dist 9.56324 10.3606 7.12017 11.0196 7.38135 9.38256 6.36749 9.75737 9.5669 14.4785 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 7.85527 5.53632 7.99623 7.21894 8.99399 4.99495 8.05937 7.45148 9.9151 7.20249 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.99949 14.8405 9.29384 10.5805 8.70296 10.8127 19.8362 13.1439 5.44303 15.6807 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 8.99949 14.8405 9.29384 10.5805 8.70296 10.8127 20.1653 13.7237 8.50562 18.6956 numMergedOcc 0
11 mol 131 unq 2 iso 0 dist 8.99949 14.8405 9.29384 8.98062 9.25558 11.2516 19.8362 13.1439 5.44303 14.8175 numMergedOcc 0
12 mol 131 unq 3 iso 0 dist 8.99949 14.8405 9.29384 8.98062 9.25558 11.2516 20.1653 13.7237 8.50562 13.2952 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.47675 7.97183 7.86572 9.00056 9.97343 5.38571 12.3922 10.1432 4.46777 6.83404 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 9.47675 7.97183 7.86572 9.00056 9.97343 5.38571 13.2114 9.43674 6.94988 11.8798 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.15806 6.37333 5.60393 5.07333 5.44002 8.46033 14.7915 14.4523 9.17946 17.31 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 9.95045 16.7146 7.83711 4.95971 9.05071 13.8622 11.8822 4.9377 6.57921 9.8664 numMergedOcc 0
