IBS-ZINC05244839 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.9130 -0.9700 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.0220 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -0.5060 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -0.1890 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -0.6710 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -1.4770 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -1.7940 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -1.3040 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -1.9680 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -2.3030 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -2.1010 2.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 -2.9290 1.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9880 -2.2470 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2390 -4.2420 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6890 -3.1980 2.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9980 -3.2710 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8360 -3.1140 2.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4220 -3.5470 4.3210 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.7770 -3.0000 5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3210 -5.0460 4.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9670 -5.3630 5.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6780 -6.5780 6.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2510 -6.9100 7.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1180 -6.0260 8.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4060 -4.8160 7.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8290 -4.4810 6.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1670 -3.1450 5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -0.5880 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -1.0980 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -1.9300 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.9820 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 0.1510 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 0.4380 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -0.4230 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.4200 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -1.5470 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 -2.0670 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -4.6950 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -4.0420 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -4.9240 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0190 -3.3230 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8270 -5.5990 3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2720 -5.3390 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 -7.2690 6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0230 -7.8570 8.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5700 -6.2820 9.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0830 -4.1270 8.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2350 -2.9580 6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6080 -2.3630 6.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8190 -3.1240 4.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.9780 -2.2120 4.1110 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 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 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 20 1 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 50 51 1 0 0 0 0 M END