0 mol 59 unq 0 iso 0 dist 9.83775 9.25208 8.24062 11.7128 5.33688 6.5096 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.75668 4.97497 8.68586 7.7933 5.35421 8.4517 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 9.64871 10.2974 9.80142 11.058 4.94316 8.06829 numMergedOcc 0
3 mol 64 unq 2 iso 0 dist 9.64871 4.97497 9.54144 7.7933 5.68303 8.4517 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 7.9258 10.8105 7.76729 13.9397 6.34759 7.99631 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 7.9258 10.8105 7.76729 13.8918 10.2377 6.40036 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.47554 6.61857 7.92688 14.5222 11.8989 9.94276 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 9.47554 6.61857 7.92688 12.7877 15.0734 9.05357 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 9.47554 6.61857 7.92688 12.4608 9.58627 5.99299 numMergedOcc 0
9 mol 140 unq 0 iso 0 dist 8.67876 6.57826 6.95323 11.5874 6.69673 5.63811 numMergedOcc 0
10 mol 140 unq 1 iso 0 dist 8.67876 6.57826 6.95323 5.8277 5.58533 7.49546 numMergedOcc 0
11 mol 140 unq 2 iso 0 dist 9.11235 6.57826 7.27371 11.5874 8.17877 5.63811 numMergedOcc 0
12 mol 140 unq 3 iso 0 dist 9.11235 6.57826 7.27371 5.8277 4.6872 7.49546 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 8.57712 6.6805 7.39644 11.4383 5.40375 7.37901 numMergedOcc 0
14 mol 187 unq 0 iso 0 dist 6.82787 10.7843 9.27478 12.2628 6.62321 7.01496 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 7.49783 4.76056 7.06793 9.89345 7.98696 8.89778 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 7.49783 10.7068 6.67585 9.89345 7.98696 9.47554 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 8.27093 6.92493 8.17891 12.8148 13.3557 7.95168 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 9.02226 9.72888 9.62609 12.8148 8.8709 6.152 numMergedOcc 0
19 mol 227 unq 2 iso 0 dist 9.02226 6.92493 6.95902 12.8148 8.8709 7.95168 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 8.6771 8.92747 9.90142 17.2332 15.7973 8.70193 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 9.58767 8.92747 5.9216 17.2332 10.438 8.70193 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 6.43546 10.9732 7.20082 8.64747 6.26168 6.34801 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 6.11671 3.83813 7.50578 11.9494 11.5772 8.76313 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 6.11671 3.83813 7.50578 9.60653 7.44916 7.4363 numMergedOcc 0
