PUBCHEM-ZINC06912718 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -1.6310 0.0820 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -0.6470 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 0.0400 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -0.6240 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0140 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.7230 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.0360 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -4.0860 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -4.2140 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -2.9320 -2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.6030 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -5.4110 -2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -5.4000 -3.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -6.5800 -1.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -7.8850 -2.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0130 -7.9620 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -8.0510 -2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -8.9270 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -8.6630 -0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -10.1430 -2.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -10.5990 -3.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -12.1120 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -12.3640 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -11.1750 -1.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2390 -11.4210 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -10.8160 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -10.0800 -1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 0.0610 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -0.3780 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 1.1250 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 1.1150 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.0630 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -2.5910 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -4.8840 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -2.8820 -4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -3.1490 -4.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -1.5330 -4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -6.5870 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -7.9190 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -9.0460 -3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -7.3110 -3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -10.2410 -3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -10.2220 -3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -12.6120 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -12.4690 -3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -12.4030 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -13.3200 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -11.3460 0.6260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 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 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END