OTAVA-ZINC05236618 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0250 1.3610 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0230 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.6960 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0210 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.4170 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 2.0780 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.6940 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -0.1000 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 -0.9660 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -2.3110 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -2.4400 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 -3.2640 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8440 -2.9640 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 -1.6760 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 -0.6600 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 0.4960 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7120 -1.3900 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1940 -1.2960 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 -1.4530 -2.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4920 -1.0380 -1.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9590 -1.0460 -3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 -0.5980 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6080 -0.6070 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8840 -1.0620 -5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6990 -1.5090 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2420 -1.4970 -3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3780 -1.0710 -7.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 12.6610 -0.6780 -7.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5020 -1.4720 -7.3390 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9710 1.8830 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5770 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7760 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 1.9780 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 3.1580 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 0.9740 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5720 -3.7610 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8980 -0.4450 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 -2.1900 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1010 -0.8460 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 -0.2430 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9730 -0.2590 -6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6950 -1.8640 -4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8810 -1.8410 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 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 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END