PUBCHEM-ZINC06468963 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.4650 1.5110 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 0.0260 0.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0380 -0.5310 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -0.3510 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -1.5520 1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -1.9360 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -1.1290 3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 0.0570 2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 0.4410 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -0.3770 -1.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.6490 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.5740 -2.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.0860 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.9990 -4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -1.5500 -5.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -3.0610 -4.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -2.5140 -3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -3.6290 -6.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -5.1230 -6.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -5.9630 -6.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -7.3470 -6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -7.8600 -6.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -7.0520 -6.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -5.6870 -6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -7.7520 -5.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 -9.0970 -5.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -9.1700 -6.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 2.1480 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 1.7080 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 1.8310 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.1980 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -2.8650 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -1.4250 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 0.6870 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 1.3700 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -0.4510 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -0.4070 -3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -1.5520 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 0.0450 -4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -1.5620 -6.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -0.9740 -6.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -2.4960 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -4.1120 -4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -2.5480 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -3.1730 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -3.1390 -7.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -3.4100 -7.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -5.5460 -7.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -7.9950 -6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -5.0830 -6.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -9.7050 -6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -9.5120 -4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.9740 -5.6530 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3340 -3.5070 -5.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 53 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END