PUBCHEM-ZINC05732655 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -4.6300 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -5.9940 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -6.9630 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -6.8160 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -8.1720 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 -7.9090 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -6.5590 0.0260 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.8990 -5.8500 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 -5.5950 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7050 -4.8550 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1660 -4.6030 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9560 -5.5360 -3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3780 -5.3050 -4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0110 -4.1420 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2210 -3.2090 -4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8020 -3.4380 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -9.0410 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5910 -8.8600 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -10.2920 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -11.0530 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -10.4950 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -11.6370 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -9.4800 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -9.7680 -0.0280 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -4.0100 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 -6.4570 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -4.8990 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6250 -4.9890 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4860 -6.5460 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4460 -5.4610 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5850 -3.9030 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2430 -6.4440 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9950 -6.0340 -5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3400 -3.9620 -6.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 -2.3000 -5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1880 -2.7070 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -9.8440 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -10.7100 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -8.9640 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M CHG 1 13 1 M END