IBS-ZINC04028360 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.5050 0.6760 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.9140 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.5010 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 3.0000 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 3.7440 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 5.1230 4.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 5.7670 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 5.0200 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 3.6340 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 2.8680 1.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4950 2.9650 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 3.4450 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 3.4580 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 2.9110 1.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 2.8030 1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 4.0950 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 4.7510 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 5.3320 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6370 5.2750 -2.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 4.6680 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 4.0650 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 5.6450 1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 6.0470 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 7.1120 3.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 7.3160 5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 6.0640 5.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -0.3470 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 0.6670 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 1.1330 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.1990 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -0.1720 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 1.0820 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 1.2490 4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 3.2440 5.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 4.4630 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 2.8290 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 2.3810 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 4.8010 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 5.8410 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 4.6450 -3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 3.5730 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 6.5320 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 6.7450 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 5.1710 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 7.5210 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 8.1280 5.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 1.4500 1.2890 N 0 0 0 0 0 0 0 0 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 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END