PUBCHEM-ZINC06026394 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 0 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 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.7500 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -2.2020 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -0.7020 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -1.1640 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 -1.3740 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 -1.1260 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -0.6620 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -0.4590 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -1.3500 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 -2.6520 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -2.8660 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 -4.1170 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -5.2110 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 -6.4370 1.5630 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7290 -6.6600 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 -7.5670 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -4.9930 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -3.7400 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 -0.2160 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 -0.1380 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7970 0.9180 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 1.9170 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1200 1.8430 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2670 0.7940 1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7520 2.9890 0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8500 4.0410 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9410 3.6750 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5620 3.0680 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7870 3.8280 -2.0840 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 -1.0200 -0.3810 0.0100 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 0.6260 -0.5790 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -0.0820 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.3730 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -2.8710 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -2.3960 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -1.3550 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -1.7310 3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -0.4690 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -0.1050 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8440 -2.0320 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -4.2800 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1440 -6.5790 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9290 -7.6560 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 -5.9130 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -7.9840 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 -8.3320 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 -7.2260 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 -5.8260 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -3.5740 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8800 -0.9120 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3960 0.9780 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 2.6200 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 0.7400 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1020 4.9870 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8960 4.1380 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8960 3.5780 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0150 4.4580 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6900 2.7290 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4920 3.5930 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7860 2.0620 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5640 4.8340 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 3.8860 -2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 3.3030 -2.3000 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 6 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 42 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 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 2 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 M CHG 1 17 1 M END