PUBCHEM-ZINC06831361 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.1450 1.5580 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.0650 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.7790 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.4270 0.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.0450 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.6870 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -0.3370 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -1.3450 -3.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -2.6300 -3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -3.0550 -1.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -3.6860 -4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -4.7260 -6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -4.8540 -6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 -5.4160 -5.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -4.5870 -4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -4.4350 -3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 0.9700 -2.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.2970 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 2.7900 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 3.4380 -4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 4.8230 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 5.5200 -4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 4.9360 -4.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 3.5880 -4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.4120 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 2.0100 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 1.9350 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 1.9000 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -4.6630 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -3.3990 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.2410 -6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -5.7020 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -5.5200 -7.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -3.8830 -7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 -5.0600 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -3.6110 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -5.4040 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -3.7440 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.7240 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.8230 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 0.9290 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 2.8700 -4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 5.3440 -5.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 6.6010 -4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 3.1580 -4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 0.1140 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -1.2870 3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 0.2460 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -3.8690 -4.8620 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2610 -2.9230 -5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END