PUBCHEM-ZINC02980011 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.4300 1.7900 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 0.2690 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -0.3840 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.3010 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -1.7270 -0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -2.5250 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -2.5480 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -3.3630 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -4.1560 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -4.1370 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -3.3200 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -3.2370 1.9070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -3.6370 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -4.8350 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -5.4180 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -4.7940 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -3.2920 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -2.5890 1.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -2.6910 1.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1430 -1.7630 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -2.3710 0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8050 -1.7000 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -3.6470 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -4.6960 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -5.8660 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -5.9880 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -4.9390 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -3.7700 -1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -5.0680 -3.6580 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0560 -6.0990 -4.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 -4.1440 -3.9270 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5410 2.2620 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 2.1000 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 2.0920 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -0.0330 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.0410 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -1.9320 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -3.3800 -2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -4.7930 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -4.7580 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -2.9070 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -5.4480 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 -6.4960 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 -5.2150 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -5.1290 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -5.0790 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -4.6020 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -6.6860 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -6.9020 -2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -2.9510 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 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 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END