IFLAB-ZINC04280352 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.8170 2.2840 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 0.8280 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 0.4520 -1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.8070 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -1.5710 -0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -1.2200 -2.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -2.5910 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -3.3190 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -2.4170 -5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -1.0920 -4.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -0.3870 -6.5590 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -1.8970 -7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -2.8920 -6.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -4.2700 -6.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -5.3620 -6.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.0900 -8.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -1.0380 -9.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 0.0800 -9.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -1.2440 -10.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -2.1570 -11.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -2.3440 -12.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -1.6290 -13.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.7230 -12.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.5310 -11.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 0.4340 -10.6490 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2200 1.1450 -11.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 0.5160 -9.4480 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0910 -0.3160 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 2.9290 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 2.3940 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 2.5660 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 0.7180 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 0.1830 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -2.5590 -2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -3.1150 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -4.2370 -4.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -3.5590 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -2.9820 -8.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -2.7140 -11.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -3.0490 -13.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -1.7800 -14.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -0.1690 -13.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.5370 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 0.0280 -3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 3 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END