MDPI-ZINC03848150 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 24 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.6780 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4140 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 3.4370 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 3.5730 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 2.3300 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -2.0250 -0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7170 -2.6050 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -1.2810 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -2.8160 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.3500 -2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9100 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 3.6950 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 4.4120 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -1.4340 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.4250 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -4.0360 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -4.5050 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 M END