BACHEM-ZINC04763714 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.0970 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0210 -1.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3590 -2.3720 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.4160 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -3.1300 0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -1.9750 0.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -2.3580 1.3470 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4180 -3.3750 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -2.2920 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 -3.3410 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2860 -3.2630 -0.4210 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -4.5560 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -1.4130 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -0.5110 2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -2.6240 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -2.8510 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -2.5570 -3.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -3.4050 -2.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -3.6220 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -4.2450 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 -3.4400 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7860 -4.0120 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9150 -5.3880 -2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -6.1920 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -5.6200 -3.1500 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.5450 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.9880 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.4480 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -1.4030 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -1.3000 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -2.4910 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -4.3330 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -3.1420 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8640 -4.3270 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 -4.6010 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1940 -5.5180 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -2.8590 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -2.6670 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -4.2880 -4.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 -2.3660 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -3.3840 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8790 -5.8340 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -7.2670 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 -6.2490 -3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -1.5720 3.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 -0.9410 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 54 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M END