IFLAB-ZINC05255630 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.6130 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.0510 1.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.9580 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.6470 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -3.4440 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -4.2150 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -3.9190 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -5.0200 -0.0970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -5.8810 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -5.3530 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -5.8730 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -6.2850 4.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -6.9690 1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -7.4130 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -6.8590 -0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -8.5690 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 -9.2090 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -10.2890 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2230 -10.7470 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 -10.1280 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -9.0320 -0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 -8.2330 -2.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -9.1880 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7850 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -3.3250 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -1.9120 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -4.1430 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -2.7610 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -7.4110 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -8.8560 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -10.7820 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -11.5950 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -10.4920 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -8.7760 -4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 -10.2290 -3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0770 -9.1330 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -2.1830 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -3.1890 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 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 13 14 3 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END