PUBCHEM-ZINC06075938 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3930 -2.7870 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.5220 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -3.5560 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -4.8720 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -5.1560 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -4.1190 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -4.0580 -0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -4.8130 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.7420 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -2.2230 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -1.9590 -2.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -1.4850 -4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -1.2760 -4.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -1.2200 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -0.7290 -5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 -0.4810 -6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1210 -0.7200 -5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8440 -1.2100 -3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 -1.4650 -3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 -1.4430 -3.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5050 -1.9450 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -0.4760 -5.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1210 -1.5510 -6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -0.0020 -7.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 0.2210 -8.2690 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 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 -1.3940 -1.5020 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -3.3480 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -5.6780 3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -6.1820 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -1.3000 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -2.9660 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -2.1260 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -0.5420 -6.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -1.8490 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 -1.2330 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -2.0860 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9900 -2.8990 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6080 -1.8560 -7.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1690 -2.3940 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1310 -1.2220 -6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 0.6020 -9.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 0.9490 -7.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -0.7170 -8.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M CHG 1 4 1 M END