PUBCHEM-ZINC04780344 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -1.7070 2.4610 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 1.0730 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 0.0620 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 0.4160 -0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -1.2350 -0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -2.2610 -0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8380 -1.9720 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -3.6180 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -3.5470 0.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -1.7260 0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0330 -1.4720 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.1450 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -0.4450 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.0900 3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.0760 3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.7800 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -1.3180 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -0.9440 3.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 -1.6790 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 0.4500 4.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 1.1610 5.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -2.4020 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 -2.2190 2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -2.7320 1.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -2.8700 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 -3.2420 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -4.5720 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4260 -4.9030 3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3580 -3.8800 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9160 -2.5730 2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 -2.2940 2.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 3.1920 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 2.4480 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 2.7300 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 0.8040 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 1.0860 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -4.4580 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -3.6500 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.3150 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 0.6360 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -1.8700 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -2.6860 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -1.1750 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -1.7360 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 2.0050 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 0.4940 6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.5270 6.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 -2.8790 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -3.6480 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -1.9240 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -5.3430 3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7420 -5.9340 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4150 -4.1020 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6350 -1.7710 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 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 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 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 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 M END