IFLAB-ZINC04060992 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.6710 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.5320 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1060 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.6160 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -3.8310 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -1.8970 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -2.5800 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -1.5420 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8120 -2.2240 0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5680 -2.5000 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6990 -3.1350 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6620 -3.2750 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4520 -2.6910 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1340 -2.6800 2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0020 -3.2410 3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1920 -3.8190 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5280 -3.8340 1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9790 -3.6910 -1.7430 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.3800 -3.1970 -3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3820 -3.6100 -4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4000 -4.1810 -4.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1460 -3.3440 -5.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.7500 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0460 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1850 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -0.9280 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 -3.1990 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4650 -3.2090 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 -0.9230 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4420 -0.9120 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2950 -2.2460 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2100 -2.2330 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7530 -3.2320 4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8610 -4.2550 3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4550 -4.2860 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2490 -2.1150 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4250 -3.6840 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3310 -2.8880 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7910 -3.6100 -6.4040 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 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 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END