PUBCHEM-ZINC06792329 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -1.5000 -1.7430 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -2.3270 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -1.7320 3.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -1.0140 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 -0.6190 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 0.1850 2.3770 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 0.0360 4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 -0.6220 4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -0.8710 5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -1.0540 6.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 0.5470 4.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4620 1.1780 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9250 1.3220 3.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2610 1.6970 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6540 1.5910 5.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4370 2.0750 6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8290 2.6650 7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 2.8000 7.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 2.3150 6.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6960 3.1940 8.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7950 3.6540 8.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2810 3.1890 10.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6720 4.2620 11.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3150 4.2840 12.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5810 3.2300 12.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2070 2.1510 12.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5600 2.1250 10.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -0.8750 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -2.6520 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -1.9320 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -0.9380 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -2.6210 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -3.1920 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -2.5350 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -1.0190 3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 0.4310 5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1360 1.1360 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5200 1.9930 6.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 3.3050 8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 2.4630 6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2520 5.0820 10.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6140 5.1190 13.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3080 3.2460 14.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6480 1.3250 12.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2810 1.2620 10.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -1.6920 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 0.0210 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -1.2930 0.7870 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.4490 1.0370 H 0 0 0 0 0 0 0 0 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 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 3 0 0 0 0 11 12 1 0 0 0 0 11 36 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 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 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END