PUBCHEM-ZINC03871803 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.4890 1.2570 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.2290 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.7600 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.8910 -1.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -2.3490 -1.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1800 -2.7360 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -2.6720 -2.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2570 -2.2850 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -4.1780 -2.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5730 -4.3830 -3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -4.7300 -2.7440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8710 -4.2870 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -4.4230 -1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -3.0220 -1.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5220 -2.5500 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -2.8130 0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -3.1470 0.3420 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2850 -2.8100 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -4.6360 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -4.6540 1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0250 -4.4380 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -2.4800 1.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9790 -1.7590 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -1.7600 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.2190 3.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -1.9910 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -5.9800 2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8070 -6.9580 1.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 -5.9560 3.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 -7.0560 4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -8.1440 4.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -9.3700 5.4940 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 -9.8810 5.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -8.6110 6.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -6.2540 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -6.7070 -2.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -6.4030 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -4.8060 -1.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -5.3510 -2.3520 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -5.7950 -1.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -4.1750 -2.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.9790 -3.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -2.0060 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 1.4900 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 1.7180 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 1.6680 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.3810 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -5.0980 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -5.1740 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -0.9250 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -2.4320 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -5.0840 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 -7.4630 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -6.6190 5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -7.7330 4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -8.6500 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -6.7560 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -6.5660 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -3.5470 2.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -3.2100 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -10.3340 5.1180 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1600 -6.4190 -3.2880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 59 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 59 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 34 2 0 0 0 0 32 61 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 39 41 2 0 0 0 0 39 62 1 0 0 0 0 42 43 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 61 -1 M CHG 1 62 -1 M END