PUBCHEM-ZINC04763931 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7530 -2.5140 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -2.6800 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.0930 2.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 -2.5700 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -3.7770 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -4.5040 -0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -4.2240 -0.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7800 -4.2520 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -3.2430 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7170 -3.6190 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 -3.0880 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8270 -3.4330 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3860 -4.3100 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6110 -4.8410 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 -4.4920 -2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -5.5620 -1.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -6.3690 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 -5.9890 0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6360 -7.5980 -1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -8.4140 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 -9.7450 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -10.8020 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -12.0230 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 -12.1870 -2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2640 -11.1290 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3260 -9.9100 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -3.7620 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.4320 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.3930 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -1.9890 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -2.2330 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -3.2800 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 -2.4020 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4320 -3.0180 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4280 -4.5810 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0480 -5.5270 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6730 -4.9040 -2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -5.8650 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 -8.5710 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6950 -7.9060 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -10.6750 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4450 -12.8500 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 -13.1400 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 -11.2570 -4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8560 -9.0840 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 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 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END