PUBCHEM-ZINC03735058 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.1870 1.6970 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.1890 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.4030 -1.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.7680 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.6440 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -4.0370 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -4.5440 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.6840 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.3010 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4450 -3.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -1.1720 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -0.2290 -4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -4.0850 -3.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -5.4590 -4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -5.6220 -5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -4.9620 0.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8160 -4.3440 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -5.8380 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -6.7950 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -7.9910 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -7.7550 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -6.3660 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 2.0130 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 2.0260 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 2.2020 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.1140 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -0.1010 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -2.2560 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -5.6180 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -0.6970 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -2.0980 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 0.7000 -4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 0.0120 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 -0.6790 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -6.0810 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -5.7690 -4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -6.6640 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -4.9950 -6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -5.3020 -5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -5.1740 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -6.4170 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -6.2650 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -7.1800 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -8.8250 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -8.3410 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -7.9930 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -8.4900 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -5.6660 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -6.4150 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -5.7980 1.0690 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0160 -6.5350 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -5.1850 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 50 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 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END