PUBCHEM-ZINC06592193 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 70 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.5930 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 0.0940 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -0.4440 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -1.9540 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -2.4870 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -4.0000 -2.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1290 -4.2330 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -4.4780 -3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -5.4510 -3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -5.8580 -5.1420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2310 -5.4520 -6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -7.3790 -5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 -7.5840 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 -6.4130 -6.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 -6.2980 -6.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -5.3970 -5.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2570 -4.3960 -5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -5.4500 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3130 -4.8260 -3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9150 -4.7550 -2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3040 -4.1160 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8510 -3.9940 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2370 -3.3550 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7560 -3.1800 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1110 -3.4830 1.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0230 -2.6340 0.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7050 -2.3720 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1240 -1.8700 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8450 -1.5980 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2840 -1.0960 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7040 -0.9250 1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -4.6870 -1.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.8380 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 2.1320 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 1.9560 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.4120 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -0.1210 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 0.0650 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -0.2190 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -2.4580 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.1810 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -1.9570 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -2.2590 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -3.9640 -4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -5.9870 -3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -7.8690 -4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -7.8090 -5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -8.5330 -6.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -7.5060 -7.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 -4.8980 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -6.4860 -3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 -5.4150 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -3.8170 -4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 -4.1730 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 -5.7650 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9840 -4.7210 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2500 -3.1220 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1610 -3.3940 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8980 -4.9860 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9470 -3.9780 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 -2.3680 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4940 -2.4040 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1140 -1.6310 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7090 -3.2990 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6830 -2.6120 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0940 -0.9560 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2880 -0.8490 3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8710 -2.5170 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -4.4040 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8790 -0.9100 3.7280 O 0 5 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 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 32 1 0 0 0 0 8 9 2 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 29 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 29 30 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 30 31 2 0 0 0 0 30 70 1 0 0 0 0 32 69 1 0 0 0 0 M CHG 1 70 -1 M END