PUBCHEM-ZINC03800857 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -3.6820 -0.2540 -4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -1.2550 -3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -1.4270 -2.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -2.1910 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -3.0400 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -3.8620 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -3.8170 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -2.1650 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -1.2800 0.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -1.8130 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -1.1030 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 0.8530 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 0.1640 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8690 1.1860 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 1.8620 2.8770 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.0210 2.9720 2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0270 3.7980 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6290 4.1470 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4060 5.1720 5.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 5.5170 5.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 4.8270 5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 3.7340 4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5310 3.4250 4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 2.3990 3.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 2.9390 3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 5.2290 5.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 6.5570 6.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5610 5.9130 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2840 0.8120 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -0.1120 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -0.6010 -4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 0.7180 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -2.2110 -4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.8840 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -0.9910 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -3.0980 -3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -4.5320 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -4.4500 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 -2.8870 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -1.6830 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -1.3420 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -1.3820 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 1.9390 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 0.5990 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 0.5590 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 0.4390 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 0.5100 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 1.9440 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7830 3.6470 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0200 2.5640 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6040 4.7100 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5310 3.2480 4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 1.9170 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 3.4300 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 2.8330 4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 4.5680 6.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 5.1800 4.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 6.2610 6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 7.1560 6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 6.1720 7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 6.8270 5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4690 5.3040 6.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 0.0630 4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 1.2560 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 0.3020 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -3.0010 0.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 0.4030 1.3780 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0280 0.6490 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 66 1 0 0 0 0 8 9 1 0 0 0 0 8 66 2 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 67 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 67 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 67 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END