IBS-ZINC02296285 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 0 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 4.1430 -0.9500 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 -1.6650 -1.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -1.9890 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4570 -1.6870 -3.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 -2.7020 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6180 -2.1030 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5470 -3.2360 -2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8440 -3.0100 -2.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3010 -1.7510 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6860 -1.5010 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1420 -0.2190 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2560 0.8570 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9110 0.6550 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -0.6570 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0790 -0.8680 -2.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7820 -4.3850 -2.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 -4.0810 -2.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 -5.0030 -2.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 -5.7460 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8320 -6.4800 -3.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3980 -7.9020 -3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9280 -8.6480 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4200 -7.9140 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8540 -6.4920 -1.4720 C 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 3.3860 -1.5470 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 0.0070 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 -1.9050 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3840 -2.3240 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2050 -0.0330 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6430 1.8660 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 1.4980 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 -4.7090 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -5.9510 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4140 -5.7030 -2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7420 -6.5230 -3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1660 -5.9490 -4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0460 -8.4250 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4870 -7.8590 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 -8.6910 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 -9.6610 -2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0860 -8.4460 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5100 -7.8710 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2060 -5.9690 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 -6.5350 -1.4620 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 2 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END