IFLAB-ZINC04163379 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.4960 1.2230 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.1780 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9680 -0.3250 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -1.2150 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -2.6420 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.8020 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.8040 -1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.6320 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 0.6760 -3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.7880 -4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.8490 -5.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 1.0280 -7.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 0.1460 -6.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.3010 -8.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 1.8650 -8.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 0.9550 -9.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 0.4200 -9.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 0.2470 -11.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -0.1330 -11.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 0.6640 -11.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 1.1160 -10.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 1.6060 -11.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 1.6240 -12.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 1.1650 -13.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 0.6750 -13.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 1.4820 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 1.9870 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 1.2890 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -1.0180 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -1.1180 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -3.3380 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.8960 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -2.6690 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -3.8210 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -1.9070 -2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -1.9510 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 1.6180 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 0.3620 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 0.8430 -3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.2780 -4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.6260 -4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 2.7640 -4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 2.5100 -6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 0.1420 -9.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 1.9680 -10.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 2.0010 -12.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 1.1860 -14.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 0.3180 -14.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.3790 -1.5080 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5190 -0.2400 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 49 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END