IFLAB-ZINC04482956 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.6080 1.6130 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 0.1180 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.6160 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.0130 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -2.7100 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -1.9680 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -0.5700 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -4.1870 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.8730 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -6.3510 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -7.1380 -2.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -6.6260 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -6.3190 -4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -7.2880 -5.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -6.9590 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -8.3510 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -8.9280 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -8.0940 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -6.6970 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -6.1380 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -4.7690 0.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -5.8200 3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -10.4190 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 1.9130 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 2.0570 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 2.0230 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -0.1060 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -2.5570 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.4680 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -0.0240 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -4.3760 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -7.4040 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -5.7570 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -8.9910 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -8.5380 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -5.2260 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -5.1500 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -6.4100 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -10.7680 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -10.7270 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -10.9120 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -5.1140 -4.4410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 42 -1 M END