IBS-ZINC04812003 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -1.5190 1.0640 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -0.3610 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -1.0300 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -2.3500 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -2.9870 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -2.3390 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -1.0110 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -3.2680 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -4.4120 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -4.2700 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -5.3610 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -6.5980 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -5.6550 -2.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1020 -5.6270 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -5.7260 -3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -4.3930 -4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -3.1680 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -8.2000 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -8.8120 -2.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6040 -8.4800 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -10.3360 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -10.9970 -2.2450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -8.2630 -0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -8.7250 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.7410 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 1.2820 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 1.2650 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -0.5220 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -2.8560 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -0.4950 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -5.0040 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -5.6140 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -6.4870 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -7.4870 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -6.5360 -3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -5.9270 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -4.2280 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -4.4720 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -3.1170 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.2500 -3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -8.8030 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -8.0940 -2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -10.7510 -2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -10.6830 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -6.8350 -1.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9180 -6.9180 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 45 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 23 24 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END