PUBCHEM-ZINC06512475 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.8630 1.9750 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 0.4920 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -0.3030 0.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -0.6130 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -0.4730 -2.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -1.1070 -0.5890 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3230 -0.2070 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -2.1400 -1.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9210 -3.0000 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -2.3900 1.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3440 -1.8610 0.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6760 -2.7070 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -0.8440 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -0.5990 2.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -1.4850 2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -1.9150 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9520 -1.6060 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0040 -2.1630 2.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9690 -2.1050 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5610 -2.8130 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -2.6840 3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -3.2810 4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -3.9750 5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5510 -4.0810 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2780 -3.5040 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -3.8190 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -3.8600 2.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -1.5840 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 -1.2250 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2690 -0.7410 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 -0.6070 -4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -0.9470 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -1.4160 -3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -1.7170 -3.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 2.5610 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 2.3130 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 2.1910 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.3050 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.1810 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -1.3970 3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -0.4650 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1110 -1.0460 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -3.2170 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6130 -4.4380 6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0770 -4.6250 6.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3580 -3.5920 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -1.3310 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 -0.4790 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 -0.2400 -5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -0.8450 -5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -1.1630 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -2.5630 -0.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -3.5930 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -4.7640 0.9660 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 52 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 26 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 34 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 54 -1 M END