PUBCHEM-ZINC01532223 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 44 0 0 1 0 0 0 0 0999 V2000 -0.7480 2.0110 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 0.7930 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 1.2630 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -0.1430 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -1.4930 0.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9870 -1.3680 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.2130 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -3.0920 -0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -1.7480 1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -2.2390 1.7410 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4090 -2.5440 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -3.3780 2.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -4.7170 2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -5.6930 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 -5.3490 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -1.1110 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -0.1690 2.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -2.3880 -0.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.4850 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -1.8530 0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -3.4940 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 2.6760 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 1.7020 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 2.5890 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 0.2700 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 1.7690 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 0.4290 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 1.9670 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 0.3910 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.3380 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -0.9750 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -3.0440 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -3.5650 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -4.5540 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -6.6420 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -5.2810 4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -5.9090 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -4.7230 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 -6.3200 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 -5.5090 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.9790 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -4.4970 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -3.4430 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -3.2870 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -1.2640 2.4410 O 0 5 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 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 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 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 M CHG 1 45 -1 M END