IFLAB-ZINC04330976 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 -1.3390 -0.1120 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.1870 0.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7120 -0.6300 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 1.5030 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 1.5320 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 2.7360 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 3.9270 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 3.9160 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 2.7130 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 0.1800 1.8540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.9780 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -2.1270 2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -0.7580 4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 0.3580 4.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -1.8930 4.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -1.9200 6.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -1.3550 7.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1580 -1.6980 6.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -1.8910 8.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -2.2530 9.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.7580 10.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -2.9260 11.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -2.5510 10.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -2.0460 9.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -3.4340 12.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -3.8500 13.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -3.5710 13.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 0.9450 7.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 2.4370 7.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 2.9180 7.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 2.2530 7.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 0.7500 7.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 0.6020 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -0.0800 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -1.1090 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 0.6160 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 2.7440 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 4.8630 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 4.8450 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 2.7320 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 1.0620 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -2.7590 4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -2.9760 6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -1.3890 6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -2.1600 8.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -3.0220 11.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -2.6500 10.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -1.7830 8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -4.6450 12.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -4.2460 14.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -3.0020 13.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -2.6000 13.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -3.9630 14.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -4.2680 12.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 0.5640 7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.7670 8.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 3.0010 7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 2.6430 6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 2.6810 7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 2.4590 6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 0.5540 8.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 0.2310 6.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 0.1800 7.0390 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7980 0.3950 6.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 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 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 63 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END