MDPI-ZINC03845493 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 0.0580 1.4630 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 0.1040 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.6550 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -0.0500 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 1.3210 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 2.0680 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 1.9820 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 2.2330 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 2.8710 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 3.2610 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5790 3.8570 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 4.0740 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 3.6970 -3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 3.0920 -3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 2.6680 -4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 2.8370 -5.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 2.0890 -3.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 1.8790 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 1.6980 -4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 1.8690 -5.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 1.1170 -4.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -0.8570 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -0.3130 -0.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 2.0530 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -0.3620 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -1.7150 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 3.1290 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9300 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 1.3320 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 3.0980 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 4.1600 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8990 4.5430 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 3.8690 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 0.9810 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.8360 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -2.1950 -0.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -2.6810 -0.7850 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 36 37 1 0 0 0 0 M END