PUBCHEM-ZINC03956359 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.4200 -0.0180 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.4840 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 1.4760 -1.9910 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.1590 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 0.3670 0.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 1.7500 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 2.7670 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.8030 3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 2.6340 2.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4600 1.6460 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 2.0630 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 2.0010 3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5540 3.3660 2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 3.9080 1.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 3.9910 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1810 4.3650 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3970 4.4910 0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 4.7000 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 5.6240 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 5.6590 -2.7280 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 4.4800 -1.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 4.0420 -0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -0.6740 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 0.3190 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 1.1580 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.7940 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 2.4790 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 3.7080 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 3.7280 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 1.9670 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0220 1.8930 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 0.6070 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 2.6920 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 1.0610 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7370 1.6500 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 1.2720 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5870 4.0810 3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5710 3.2760 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 4.4330 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 4.7130 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 6.2400 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 1.6940 1.1610 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5610 0.8030 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END