PUBCHEM-ZINC01197141 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.9460 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -0.5570 -2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 -1.5920 -1.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.8240 -3.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3980 -0.9790 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 -1.9740 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9130 -1.4060 -4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2870 -1.5440 -4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9510 -2.2500 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 -2.8170 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 -2.6750 -2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4220 -2.3980 -3.3350 N 0 3 0 0 0 0 0 0 0 0 0 0 12.0490 -1.8980 -4.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0070 -3.0190 -2.4660 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0520 -3.0820 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -3.1020 -4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -1.9630 -5.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -2.0180 -6.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -3.1900 -7.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -4.3130 -6.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -4.2940 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -5.4360 -4.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -5.3840 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 -4.2100 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -4.1910 -1.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -1.9030 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3950 -0.8550 -4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8430 -1.1010 -5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 -3.3680 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 -3.1150 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -1.0470 -5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -1.1410 -7.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -3.2080 -8.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -5.2140 -7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -6.3500 -4.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -6.2620 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -3.9320 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 32 51 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END