PUBCHEM-ZINC04774282 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.2420 1.1060 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -0.2390 -0.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -0.7750 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -0.1660 -1.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -2.0580 -1.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -2.8710 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -4.2740 -1.8520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6150 -4.1820 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -5.1870 -2.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6850 -5.7840 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -6.1120 -3.4570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4930 -7.1090 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -6.2050 -2.3770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2400 -6.9400 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -4.9420 -1.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -6.5830 -2.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -5.7440 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -6.3880 -3.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -7.7120 -3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -7.8540 -2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -8.9970 -2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -10.0510 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 -10.0660 -3.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -8.8850 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -8.8840 -3.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -5.4870 -4.5710 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8380 -4.4940 -3.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -4.5990 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 1.1870 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 1.8000 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 1.3370 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.8030 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -2.4900 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -2.9100 -3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -2.3680 -2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -4.6810 -3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -11.0170 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -8.0060 -4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7730 -9.7630 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 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 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 26 -1 M END