IBS-ZINC00272331 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -2.0790 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -2.8700 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -4.2900 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -4.5290 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -3.0250 -0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -5.3580 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -6.3940 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -7.3860 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -7.3530 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -6.3270 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -5.3330 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -2.3440 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -2.1190 -1.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -5.5130 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -6.4210 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -8.1900 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6360 -8.1320 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -6.3060 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -4.5340 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 -2.1070 1.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -1.7590 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 22 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 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 28 29 1 0 0 0 0 M END