IFLAB-ZINC02457412 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.1070 1.8330 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 0.3610 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.1110 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -1.4850 -2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -2.4190 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -1.9380 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -0.5560 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.8720 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -3.7750 -1.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -4.5230 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -5.8620 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -6.5940 -1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -5.8290 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -4.4670 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -7.9000 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -8.4470 -1.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -8.6920 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -9.1670 -3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -9.9370 -3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -10.2490 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -9.7780 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -9.0080 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -11.0850 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -11.4550 -4.4500 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5310 -1.9250 -3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 2.2560 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 2.0260 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 2.3510 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 0.5990 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.1940 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -3.7050 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.3640 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -3.2590 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -4.7120 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -3.9570 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -6.4620 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -5.6870 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -6.3790 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -5.6840 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -3.8680 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -4.6270 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -8.9440 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -10.3050 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -10.0220 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -8.6640 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -2.3410 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.6720 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -1.0860 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -11.3570 -2.3500 O 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 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 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 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 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 49 2 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M CHG 1 24 -1 M END