PUBCHEM-ZINC00662956 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7430 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -2.0200 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -2.7080 1.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.6460 1.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3260 -2.4200 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -2.0600 -0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8800 -2.3640 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9220 -0.2340 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 0.0380 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 -0.6990 -1.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.3680 -1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 1.8480 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -2.5680 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -2.3050 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -2.7710 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -3.5000 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 -3.7630 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -3.2930 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -4.5450 -2.5030 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.1430 -4.9560 -2.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -4.7760 -3.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5990 -4.1390 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -4.6880 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -4.8590 1.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.2920 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -0.2210 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -0.0880 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 1.5240 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 1.4440 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 2.9370 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -1.7350 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -2.5660 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -3.8650 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -3.4950 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -6.7120 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -6.4880 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -6.7530 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -0.1670 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END