PUBCHEM-ZINC02978255 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.2730 1.7800 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 0.2800 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -0.3340 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -1.7100 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -1.8940 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -0.5140 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -2.7040 -2.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.1030 -3.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5510 -1.1540 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -1.8660 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.8070 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -2.5900 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -1.4320 -4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -0.4910 -4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -0.7110 -4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 0.7490 -5.2190 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9370 0.9410 -5.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 1.5770 -5.6160 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5090 -3.0350 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -4.4050 -4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -5.2740 -5.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -4.7840 -6.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -5.6510 -7.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -5.1050 -8.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -3.7250 -9.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -2.9210 -8.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -3.3920 -6.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -2.5220 -5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -1.1810 -6.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 2.0700 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 2.1080 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 2.2440 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 0.2580 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -2.1920 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -0.0680 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -3.6660 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -3.7120 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -3.3240 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -1.2610 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 0.0220 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -4.7850 -3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -6.3340 -5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -6.7180 -7.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -5.7410 -9.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -3.3060 -9.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.8660 -6.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -2.4430 -0.0110 N 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 47 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 47 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END