PUBCHEM-ZINC02970354 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0190 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4250 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 1.8450 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 0.8110 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -0.3520 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -1.5510 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -2.9590 -0.0440 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 -1.6930 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -2.5840 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -0.5860 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 0.7000 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 1.8290 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1250 1.6840 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6970 0.4090 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8860 -0.7270 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1680 0.2620 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -0.8460 -0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9540 1.3570 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4120 1.2120 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0530 2.5760 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3890 3.2670 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9670 4.5000 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0990 4.8110 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4780 3.4970 -1.5380 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.7670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 2.8150 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 2.5580 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3300 -1.7110 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5550 2.2410 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7310 0.6600 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7150 0.6690 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2240 2.8920 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2860 5.1610 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5260 5.7280 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 M END