PUBCHEM-ZINC05736754 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5260 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -3.8860 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -4.8700 1.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -4.7380 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -6.0690 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -5.7850 3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -4.4320 3.6480 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8770 -3.7030 4.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -3.4730 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -4.4060 6.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -4.1940 7.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -3.0500 7.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.1170 6.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -2.3260 5.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -6.9020 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -6.7020 5.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -8.1600 3.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -8.3840 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -9.5320 2.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -7.3830 1.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -7.6940 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -9.2960 4.6860 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -1.8940 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -4.2880 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -2.7440 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -5.3000 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -4.9230 8.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.8850 8.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -1.2230 6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.5950 5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -7.7560 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -8.6480 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -6.9090 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -9.5920 5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -10.1320 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -9.0080 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 11 1 M END