IBS-ZINC02427136 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 73 0 0 0 0 0 0 0 0999 V2000 0.0690 0.8550 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.6540 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.9520 -2.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -1.1100 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -2.5510 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -1.1090 -3.6920 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -1.9050 -4.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -1.4560 -3.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 0.4890 -4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 0.9000 -5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 2.1540 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 3.0020 -5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 2.5930 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 1.3270 -4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 3.5000 -4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 4.9620 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 5.3810 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 4.2900 -3.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 3.1470 -3.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 4.2980 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7280 3.1050 -3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0500 3.1170 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 4.3150 -2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 5.5050 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 5.4990 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 5.8090 -4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 7.1480 -4.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 8.1340 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 7.8300 -5.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 9.3710 -5.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 9.6490 -4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 8.1200 -4.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 10.8850 -4.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 12.0720 -5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 12.7840 -6.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 13.0850 -5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 11.7730 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 11.0480 -4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 1.2000 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.3650 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 1.0770 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.1640 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -0.9990 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -0.8840 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -0.4270 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -2.6680 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.7760 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -3.2330 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 0.2400 -5.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 2.4690 -6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 3.9810 -6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 1.0030 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 6.4020 -3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2420 2.1690 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5970 2.1890 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7070 4.3210 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 6.4390 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1070 6.4280 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 5.3680 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 12.7450 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 11.7670 -5.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 13.7180 -6.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 12.1440 -7.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 13.7060 -4.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 13.6140 -6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 11.9870 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 11.1420 -6.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 10.0690 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 11.6360 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 2 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 23 24 2 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 M END