IBS-ZINC02251423 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.0740 1.5830 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 0.0600 0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5960 -0.4070 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.3400 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.5460 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.4710 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -0.3010 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -0.5130 -1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -0.4530 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -0.8220 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -0.8040 -2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -1.0920 -4.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -1.3840 -5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -1.3940 -4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -1.1130 -3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 0.1970 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 -0.2420 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -2.0200 1.3710 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -2.6120 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.0030 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 1.9710 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 2.0480 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 1.9240 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -0.0450 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.0880 -4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -1.6050 -6.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 -1.6220 -5.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -1.1200 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 1.2730 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -0.0100 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 0.2920 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 0.0130 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -3.7020 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -2.3800 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -2.2070 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -2.4170 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -0.4820 0.1350 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.3020 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 37 1 M END