PUBCHEM-ZINC05973456 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 1.1470 1.3760 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.1170 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.5550 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -2.0530 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -1.8650 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.0050 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -1.3690 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 -1.4930 4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -4.0430 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -4.5610 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -5.6890 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -6.2410 5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -5.5880 5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -4.4700 4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -3.9750 3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -2.8720 3.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7260 -6.0670 6.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -7.0440 7.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -8.1220 7.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8140 -8.7540 7.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -7.4590 6.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3970 -7.0450 6.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -8.5360 5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -9.4820 4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -10.1330 5.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1170 -9.0030 6.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4880 -8.3600 5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 -9.7110 6.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7450 -10.6390 5.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -10.8580 4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 -11.5560 3.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -11.1490 6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 1.6480 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 1.6660 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 1.9550 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.3620 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -0.6650 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.3070 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.0120 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -2.3330 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -2.6020 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -0.8130 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.3130 4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -1.5160 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -3.0600 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -1.8530 5.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -0.3090 4.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -0.9910 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -2.5430 4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.0320 5.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -4.4170 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -4.3970 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -6.1320 4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 -3.9940 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -2.6820 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -6.5340 6.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -5.2070 7.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 -7.4960 8.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -6.4920 8.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -9.1390 6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -8.0980 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -10.2470 4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -8.9230 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -9.0180 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -10.2840 7.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 -10.1450 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 -11.5840 5.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -11.9050 5.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -11.6960 6.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -10.6880 7.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -2.5250 2.4150 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2470 -2.2790 2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 4 71 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 71 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 9 71 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 31 2 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 71 1 M END