PUBCHEM-ZINC04613856 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 65 0 0 0 0 0 0 0 0999 V2000 0.5690 0.7290 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1730 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -1.0160 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -1.9230 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.7660 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -3.6730 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 -4.5210 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -4.4940 -0.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -5.3470 1.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -6.2190 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9330 -7.3850 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 -9.7240 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7300 -10.7470 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9280 -10.2520 -1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3890 -8.9210 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2570 -7.8820 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5570 -11.0740 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1190 -12.1870 -2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8210 -10.5270 -2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4620 -11.5250 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7330 -10.9530 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3760 -11.9520 -5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6460 -11.3800 -5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2870 -12.3690 -6.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 1.3220 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 0.1400 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.4190 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -0.8280 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 0.4440 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -0.3560 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -1.6270 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -2.5820 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -1.3110 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 -2.1090 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -3.3760 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -4.3450 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -3.0690 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -5.3310 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6280 -6.5980 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 -5.6030 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 -7.0550 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 -7.9260 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 -10.0670 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2320 -9.5270 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 -11.6840 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0240 -10.9660 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2000 -8.5550 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7940 -9.0360 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8880 -7.6850 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6030 -6.9510 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5370 -10.2780 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5600 -9.6130 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7460 -11.7890 -4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7010 -12.4530 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4490 -10.6920 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4920 -10.0270 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6600 -12.2120 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6160 -12.8780 -4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3670 -11.1220 -5.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4110 -10.4560 -6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1940 -11.9400 -7.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6040 -12.6240 -7.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5650 -13.2940 -6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -8.3920 0.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.4060 -8.5840 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 64 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 12 64 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 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 64 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 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END