ASINEX-ZINC04943995 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -2.8470 0.3850 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -4.2230 0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -2.2800 1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -2.5010 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -3.2970 -1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 -3.0280 -2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8450 -1.9580 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -1.1610 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -1.4380 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 0.0020 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 -1.6900 -3.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 -2.5520 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -2.1050 -5.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5400 -1.1430 -5.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0500 -2.7740 -7.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 -2.3500 -7.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9960 -3.5490 -8.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1360 -4.7140 -8.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1470 -5.1230 -7.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -3.9380 -7.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0240 -5.8850 -9.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2250 -5.7960 -8.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4820 -7.0300 -9.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -2.4710 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -4.1300 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -3.6500 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -0.8200 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 -0.3310 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 0.7830 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9840 0.3960 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -2.5110 -5.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 -3.5750 -4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6870 -1.5520 -7.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6320 -1.9930 -8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5260 -3.8480 -7.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7160 -3.2740 -9.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5870 -4.4060 -9.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -5.4070 -6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5510 -5.9680 -8.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -3.7080 -8.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5770 -4.1890 -6.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5220 -7.1010 -9.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0540 -7.7830 -9.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 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 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 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 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END