PUBCHEM-ZINC04614471 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -1.0970 1.8470 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 0.4940 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.1600 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.5130 -1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.1570 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -1.5910 -3.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -3.3640 -2.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -4.0060 -3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -3.2620 -5.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -3.8960 -6.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -5.2720 -6.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 -6.0220 -5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -5.3890 -4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -7.4160 -5.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -8.1000 -4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -7.5030 -3.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -9.6070 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -10.1300 -3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -11.6600 -3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -12.1830 -2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -5.9480 -7.4670 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3340 -5.3020 -8.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -7.1490 -7.6010 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3200 2.4920 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 1.6990 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 2.3130 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 0.6420 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -0.1510 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.3080 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 0.4850 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -1.3650 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.1580 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -3.7860 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -2.1860 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -3.3150 -6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -5.9700 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -7.8900 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -9.9620 -5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -9.9700 -4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -9.7760 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -9.7670 -4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -12.0140 -4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -12.0230 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -11.8290 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -11.8200 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -13.2730 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END