PUBCHEM-ZINC06228870 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.3990 1.3410 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -0.0880 -0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -0.5440 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 0.1730 -1.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -1.9960 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.7630 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -4.0900 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -4.1560 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -2.8640 -0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -2.5820 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -2.6190 0.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2290 -3.3580 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -2.9260 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -1.9150 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 -1.2950 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 -2.2790 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -2.8630 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -3.4850 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -1.3490 0.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -0.9310 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -5.5140 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -6.1760 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -5.3310 -2.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 1.7900 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.7240 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 1.6010 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -2.3950 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -3.3470 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -1.6170 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -3.9860 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -2.3320 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -1.1560 3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -2.7440 3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5500 -0.9480 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -0.4100 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 -3.0900 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9490 -1.7770 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 -3.6200 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -2.0730 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 -4.3370 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -3.8080 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -5.9530 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -7.2260 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -2.4610 1.9800 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9960 -1.6660 1.3130 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 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 40 1 0 0 0 0 18 41 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END