PUBCHEM-ZINC05694902 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -2.8320 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -3.3090 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -3.5420 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -3.2940 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -2.8210 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -4.0250 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5850 -4.2170 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8990 -4.7600 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6540 -4.8180 0.9020 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.4470 -4.4090 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2470 -4.4820 2.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.2360 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3880 -4.9620 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2820 -5.1680 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6110 -5.6880 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4240 -5.8970 1.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9160 -5.9320 3.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0200 -5.7020 4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3340 -5.9340 5.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7810 -5.2460 4.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -5.0240 5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2410 -6.4540 4.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2080 -7.9610 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5870 -8.6360 5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8760 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8880 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.3660 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.3550 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -0.1720 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -0.1830 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.4260 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -2.4140 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -2.6500 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -3.5010 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 -3.4740 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -2.6320 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7550 -3.2680 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1390 -4.9440 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7240 -4.0820 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1090 -5.7560 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9700 -4.0090 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0560 -5.7360 6.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -5.1600 5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5200 -6.1080 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9720 -6.0980 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8710 -8.4830 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5630 -9.7160 5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9230 -8.1140 5.9370 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 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 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 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 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M CHG 1 14 1 M END