PUBCHEM-ZINC02980870 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 0 0 0 0 0 0999 V2000 -0.4630 1.7780 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 0.3040 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.5050 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -0.2840 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -0.7420 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -1.2800 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -1.3830 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -0.9160 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.3750 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -1.8740 1.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -3.1200 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -4.3320 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -4.3390 1.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 -5.4490 -0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -6.5510 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -7.9130 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 -7.0000 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6690 -5.6260 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9250 -9.4790 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -0.6630 1.5940 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7600 -1.3280 2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 0.3930 2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 0.0220 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3360 -0.5190 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7950 0.0320 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 1.1220 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0150 1.6720 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 1.1310 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 2.2090 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 2.3600 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 1.9120 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 0.2590 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -0.4640 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -1.5580 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -0.1180 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -0.6750 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 -1.5940 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -0.9730 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.0200 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -3.3850 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 -2.9550 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -6.5300 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -6.4030 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 -8.7240 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -7.9830 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7520 -7.0850 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1150 -7.1700 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4090 -4.8480 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3490 -5.5200 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3430 -9.5780 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -10.2220 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -9.5700 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8720 -1.3560 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6760 -0.3770 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4930 1.5530 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 2.5290 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 1.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -8.1140 -0.9260 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9200 -8.0520 -1.8780 H 0 0 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 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 58 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 58 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END