IBS-ZINC02445000 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 1.1330 0.5080 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -0.7940 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -1.4110 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -0.5700 -0.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6780 0.1050 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 0.0890 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -0.5470 -2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 1.4600 -1.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 1.9660 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 2.3590 -1.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9750 1.8640 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 2.7680 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 1.6060 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 1.9840 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 3.2090 -0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 3.6900 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 3.9560 -1.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -1.8000 0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -1.7560 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.7610 2.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -3.0080 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -3.1010 2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -4.3260 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -5.4450 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -5.3330 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -4.1050 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -4.0350 -0.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -2.9380 -0.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.3350 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 0.9100 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 1.2720 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -1.4820 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.7590 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.3850 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -1.5640 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 3.2260 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 3.5440 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 1.1060 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 0.8680 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -2.2250 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -4.4060 4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -6.4030 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -6.2110 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 0.9970 -0.1860 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3320 4.3210 -3.3180 O 0 5 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 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 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 2 0 0 0 0 14 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 44 -1 M CHG 1 45 -1 M END