PUBCHEM-ZINC06380776 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5720 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -2.4260 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -3.7590 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -4.0240 0.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -2.3420 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -1.6870 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4590 -1.7140 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 -2.1510 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6150 -1.4830 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2860 -1.7900 0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5880 -1.4930 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -2.1610 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5200 -2.3330 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0860 -2.5730 -0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1960 -2.6430 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5750 -3.2480 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2510 -3.5580 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4780 -3.1040 2.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.0630 -2.5340 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7390 -3.6050 4.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8050 -3.4950 4.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7520 -4.1390 6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6410 -4.8950 6.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5830 -5.0140 5.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6150 -4.3710 4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7470 -4.3020 3.3910 N 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -4.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -0.6280 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6890 -1.8520 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -3.2340 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 -0.4040 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2090 -1.8660 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4690 -0.4150 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1650 -1.8840 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 -3.2440 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 -1.8700 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5900 -3.3540 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3070 -1.7250 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1810 -2.5380 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4630 -4.1660 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6710 -2.9080 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5800 -4.0540 6.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6130 -5.3940 7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7240 -5.6040 5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 M END