CHEMBRIDGE-ZINC00443252 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -2.8710 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 -2.0400 2.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -2.6500 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -3.8200 3.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -3.9250 2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -2.1430 4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0650 -2.9060 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7450 -2.4270 6.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3690 -1.1930 6.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3150 -0.4320 5.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 -0.8970 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0970 -0.6860 7.9650 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.1470 -1.3540 8.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6470 0.4000 7.9220 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -2.0080 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -3.5830 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 -3.8700 5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 -3.0170 7.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8040 0.5300 5.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5890 -0.3000 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END