PUBCHEM-ZINC03678460 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 1.8680 1.7520 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 0.3310 1.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.2150 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 0.4070 0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -1.7320 1.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8630 -2.1400 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.3510 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -2.2260 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -2.3320 4.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -2.5790 3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -2.6120 5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -2.4020 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -2.1550 6.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.1260 5.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.9040 5.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.7220 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -1.9740 3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.7540 3.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0050 -0.6720 3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.4530 4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -1.7450 4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 -2.3820 5.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -3.7320 5.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -4.4470 5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -3.8140 4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -4.2210 6.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -5.5700 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -5.8530 7.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 -5.4670 8.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5420 -5.7090 9.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6260 -6.3290 8.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5420 -6.7050 7.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3720 -6.4650 6.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 2.2440 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 2.0780 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 2.0240 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -1.8930 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -3.4190 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -2.7420 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -2.8010 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -2.4290 7.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -1.9910 7.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -0.6920 4.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -1.8200 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -5.5000 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -4.4020 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -5.7200 7.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -6.2590 5.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 -4.9720 9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 -5.4080 10.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5380 -6.5150 9.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 -7.1810 7.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3270 -6.7560 5.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -2.1610 1.9790 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9870 -3.1800 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -1.7480 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 54 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 54 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 26 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 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 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 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 54 1 M END