PUBCHEM-ZINC03737836 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.2670 2.3300 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 0.9140 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.0700 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.3690 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.2650 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -1.8780 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -1.5880 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -0.6820 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -0.3910 0.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8330 0.2750 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -1.6090 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -1.8550 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -3.1070 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -3.8850 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -5.1180 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -5.5530 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -4.8000 2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -3.5830 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -2.6540 1.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -2.7480 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -5.9350 4.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -0.9020 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 0.4890 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.4480 -4.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -2.3770 -5.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 2.3930 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 2.6840 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 3.0140 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 0.5850 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 0.9150 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 0.1030 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -2.5850 -3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -2.0990 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 -3.5290 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -6.4990 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -5.1530 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -5.6500 5.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -7.0040 4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -5.7840 4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 -0.8180 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -1.2890 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 1.0060 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 1.1150 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -2.4140 -6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.0510 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -3.3840 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 0.3740 0.0310 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2080 -0.1000 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 1.3050 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 47 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 47 1 M END