IBS-ZINC02128440 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 -0.9370 -1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.5880 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -1.9540 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -1.8340 -2.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -1.4490 -4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8900 -1.9600 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -3.0970 -4.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9740 -2.5280 -3.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8070 -1.8250 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2440 -3.6480 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -4.0820 -1.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4790 -4.1630 -2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6650 -5.2390 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1260 -5.6940 -1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7760 -4.8370 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3510 -6.7410 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6720 -7.5800 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7990 -7.2340 -0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4770 -6.4050 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0730 -7.7890 -1.5640 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4300 -8.6500 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7820 -6.7020 -2.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4540 -5.8580 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4280 -6.2650 -2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9820 -7.2300 -3.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4420 -8.1880 -1.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9990 -8.2640 0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1040 -6.1550 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -1.9090 -4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -0.3640 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -2.3510 -6.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 -1.1690 -5.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 -4.0250 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 -3.2410 -5.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4090 -4.8850 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -6.0770 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8140 -6.5940 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6870 -8.5500 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8960 -8.6230 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2280 -6.7630 1.9250 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 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 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 35 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 34 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 M END