PUBCHEM-ZINC05977731 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.1020 1.5400 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 0.0100 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.5260 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -2.0540 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -2.4680 0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -2.0050 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -0.4760 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -3.8470 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -4.6920 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -6.0570 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -6.5940 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -5.7420 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -4.3780 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -3.4760 0.3620 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3320 -3.9400 0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -2.2680 0.3640 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3190 -8.0560 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -8.5220 0.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -8.8760 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -10.2590 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -11.1360 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -12.5000 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -12.9980 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -12.1220 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -10.7530 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -12.5920 -1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -13.9600 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -14.8090 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -14.3450 -0.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 1.9040 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 1.9210 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8850 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.3550 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -0.1290 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.2190 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -2.4380 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -2.4510 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -2.3540 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.4020 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.1320 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -0.0770 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -4.2770 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -6.7120 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -6.1540 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -8.5090 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -10.7510 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -13.1800 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -10.0720 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -14.2870 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 -14.0630 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -14.7000 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 -15.8560 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 33 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 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END