CHEMSTAR-ZINC04090636 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.3090 0.7250 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.7690 -0.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5940 -1.1030 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -1.5390 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -2.1760 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 -2.8820 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -2.9510 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -2.3150 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -1.6120 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.0020 1.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -0.8600 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -0.6130 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -0.4720 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -0.5780 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 -0.8230 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.9590 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -1.2150 3.5810 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9450 -0.7000 3.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -1.9410 4.4370 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9000 -0.2250 -1.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -0.1110 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -0.0220 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 1.0760 -3.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 1.1050 -3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 0.9720 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 2.2500 -3.6900 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 3.3810 -3.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6330 2.2770 -2.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 1.6100 -5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 1.2810 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 0.8980 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.0590 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -2.1220 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -3.3790 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -3.5020 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 -2.3680 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -1.1180 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -1.2560 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -0.5320 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -0.4690 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -0.9050 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 0.7860 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 -0.9880 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 0.1780 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 -0.9600 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 2.0500 -3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 0.2760 -3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 0.8800 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 1.8540 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 1.4560 -5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5850 2.3270 -5.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 0.6620 -5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END