PUBCHEM-ZINC03752801 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.2230 1.6250 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 0.1560 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -0.5200 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -1.9960 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -2.5420 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -3.8730 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -4.7380 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -6.0870 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -6.5350 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -5.7030 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -4.3520 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -6.4910 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -7.7760 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -7.7820 0.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -8.5990 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -8.9950 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 -9.5570 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4140 -10.7380 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7990 -11.3770 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -10.8370 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -9.6250 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4700 -9.1060 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 -9.7660 3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 -10.9620 3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -11.4920 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0690 -5.9950 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -5.7680 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0180 -6.8040 -3.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 2.0890 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.7440 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 2.1690 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.3510 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.0720 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -0.0100 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.4300 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -2.5160 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -2.0850 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -4.3970 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -6.7540 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -3.6840 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -9.0680 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6810 -11.1590 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3680 -12.3010 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -8.1610 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6630 -9.3360 4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9080 -11.4790 4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4380 -12.4240 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8870 -6.7020 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -5.0580 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7610 -4.5630 -2.7360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 50 -1 M END