PUBCHEM-ZINC06585183 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0400 1.5380 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.1890 -0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -0.5010 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 0.2480 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 1.6290 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.3420 -0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 2.0890 0.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 0.9920 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -0.1380 0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 3.4780 0.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0380 4.0930 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 3.9590 1.6920 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0470 3.1890 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 5.1330 1.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0240 5.3990 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 4.6900 -0.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8160 5.4980 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 3.6360 -0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2330 4.1100 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 3.7940 -1.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0210 3.3260 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 6.2910 1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 6.0370 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 4.4360 2.4330 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0790 -1.8810 0.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -2.6820 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -3.9900 0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -4.8520 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -5.2540 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -4.0920 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -3.2240 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.9570 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 2.0390 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 1.0810 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9180 4.8270 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 3.1860 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -2.3130 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -2.1510 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -4.5900 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -3.7480 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -5.7680 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -4.3380 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -5.7240 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -6.0200 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -4.4920 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -3.4630 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -3.6840 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -2.2640 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.1060 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -3.8010 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 28 29 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 29 30 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 30 31 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 32 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 M CHG 1 24 -1 M END