OTAVA-ZINC04745180 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -0.9120 1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -0.5660 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -1.0500 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -1.0860 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -0.6420 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -0.1600 -3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -0.1150 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -0.6800 -4.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -0.2080 -5.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -0.6700 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.4370 0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -1.1670 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -1.2840 1.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -0.2990 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 0.8120 2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -0.7940 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 -0.2410 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7540 -1.0000 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 -2.3040 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2770 -2.8710 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 -2.1240 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -2.3940 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -3.4400 1.1280 O 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 -3.9470 -1.3950 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -1.4590 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 0.1830 -4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 0.2640 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 0.8350 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -0.8080 -6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 -0.2930 -6.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.4640 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -2.1430 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 0.7780 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7410 -0.5690 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 -2.8850 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -3.8900 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 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 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END