PUBCHEM-ZINC06005977 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3720 -0.5110 0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1170 -0.7760 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -0.6760 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -1.0280 -3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -1.4870 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -1.5950 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -1.2410 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -1.2300 0.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -1.4960 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -0.7810 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -0.6170 2.4950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7800 0.1360 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -1.9510 2.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -1.7590 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -1.9200 5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -1.7440 6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -1.4070 6.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -1.2460 5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.4270 4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -0.1940 3.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -0.8530 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 1.1130 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 1.9400 2.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 1.5400 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 0.5940 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 0.9990 5.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 2.3410 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 3.2850 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 2.8930 4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 4.7440 5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -0.3190 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -0.9480 -4.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -1.7620 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 -1.9520 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -2.6810 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.3100 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -2.1840 5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -1.8690 7.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.2680 7.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -0.9820 5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -1.3050 3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -0.4540 4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 0.2680 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0190 2.6540 6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 3.6310 3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 5.1960 6.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5980 5.2510 4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9090 4.8420 5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M CHG 1 3 1 M END