PUBCHEM-ZINC03738370 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 -0.0920 1.8010 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 0.3970 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -0.3370 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -1.7480 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 -2.3550 0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -3.6290 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -4.4060 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -5.6980 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -6.2200 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -5.4520 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -4.1560 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 -5.9990 -0.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1770 -5.1980 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -6.6110 -2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -7.7970 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 -7.9980 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4900 -9.0030 -4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5630 -8.8930 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 -7.7900 -6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -6.7770 -5.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 -6.9070 -4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7400 -6.0740 -3.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -5.2010 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -9.9350 -6.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -9.8950 -7.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0630 -11.1320 -8.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4590 -11.1180 -8.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1420 -12.2690 -8.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4400 -13.4460 -9.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0540 -13.4750 -8.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3680 -12.3250 -8.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 -8.6380 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -7.8130 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 2.3080 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 2.3980 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.7730 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 0.4590 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -0.1630 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -0.3930 1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 0.2230 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -1.6920 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -2.3250 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -4.0390 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -6.3000 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -7.2290 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -3.5300 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 -9.8650 -3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0420 -7.6770 -7.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9270 -5.9220 -6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -9.0050 -8.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -9.8790 -8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0220 -10.2110 -8.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2240 -12.2490 -8.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9730 -14.3420 -9.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -14.3940 -9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2880 -12.3660 -8.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -9.0520 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -9.4800 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7310 -7.0900 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -8.4610 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6280 -7.0210 0.2630 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8290 -7.6650 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 -6.5360 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 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 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 61 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 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 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 M CHG 1 61 1 M END