PUBCHEM-ZINC00027048 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.1120 1.7920 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.2730 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -0.2950 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -1.6320 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -2.3060 -0.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -2.2780 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -2.7620 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -3.2620 -4.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -3.1240 -3.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -2.5170 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -2.1670 -1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -3.5420 -4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -4.1660 -3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -4.5770 -4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 -4.3680 -5.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -3.7470 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -3.3390 -5.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 -3.5260 -7.7060 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1290 -3.8900 -8.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 -2.9790 -8.4280 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6310 -2.7120 -4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.2110 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 2.0280 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 2.2180 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 0.0370 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -0.1470 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -3.0320 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -1.8800 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -1.3360 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -4.3280 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 -5.0610 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6190 -4.6910 -5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 -2.8580 -6.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.7810 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -3.5570 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -2.7600 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 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 10 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 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 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END