PUBCHEM-ZINC04187174 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 61 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -4.0650 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -5.2390 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -6.6160 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -7.7900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -9.2610 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 -9.7910 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -11.3210 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -11.8500 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5870 -13.3800 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 -13.9100 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 -15.4400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 -15.9690 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4160 -17.4990 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7570 -17.9940 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9160 -19.3430 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1900 -19.8920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3500 -21.2640 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2420 -22.0900 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9710 -21.5460 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8060 -20.1740 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4160 -23.5600 -0.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.5350 -24.0410 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4400 -24.2890 -0.0380 O 0 5 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -9.6130 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -9.6220 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -9.4390 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -9.4300 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -11.6720 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -11.6820 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -11.4990 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1350 -11.4890 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -13.7320 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -13.7410 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5320 -13.5580 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 -13.5490 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -15.7910 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4740 -15.8010 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9470 -15.6180 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9640 -15.6080 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9060 -17.8500 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -17.8600 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0570 -19.2470 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3420 -21.6920 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 -22.1930 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8130 -19.7490 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 3 0 0 0 0 7 8 1 0 0 0 0 8 9 3 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END