CHEMBRIDGE-ZINC00303788 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -0.6580 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -0.4360 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -1.1430 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 -1.2930 -1.8730 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -1.8610 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -2.0730 -4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 -2.5180 -5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -2.7540 -5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2040 -2.5440 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -2.0920 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -1.8620 -2.2450 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6820 -2.0660 -2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 -1.4700 -1.2070 O 0 5 0 0 0 0 0 0 0 0 0 0 7.0380 -3.2400 -7.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 -3.3770 -7.9880 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 -2.3170 -7.4420 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 -4.4790 -6.7890 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -2.1150 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -0.4300 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -1.8900 -4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 -2.6830 -6.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -2.7290 -4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END