IBS-ZINC04793906 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -2.5140 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -3.8620 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -4.3890 3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -5.7570 3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -6.6060 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -6.0770 1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -4.7090 1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -7.9920 2.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -8.8260 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -10.1770 2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -10.7220 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -11.1530 4.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -11.0780 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -12.3790 1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -13.0260 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -12.2480 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -10.5630 -0.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -14.5070 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -15.1390 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -16.5170 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -17.2770 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -16.6500 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -15.2690 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -17.6090 1.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -18.8180 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -18.6290 0.1560 O 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -3.7280 4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -6.1670 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -6.7360 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -4.2980 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -8.3610 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -8.4160 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -12.5960 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -14.5510 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -17.0060 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -14.7810 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -18.9250 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -19.6850 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 3 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M END