PUBCHEM-ZINC06198569 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 0.4020 0.8650 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 1.1390 3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 3.0510 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 3.6980 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 5.1690 2.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 5.7210 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 5.9080 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 7.0040 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 7.1510 3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 8.2770 4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 8.3780 5.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 7.3460 5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5470 6.2280 4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 6.1350 3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 5.0110 3.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8630 4.2730 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 4.8370 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 3.8330 1.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 7.3710 6.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 8.3660 7.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 9.6740 6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 9.5160 6.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 5.9900 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 7.5690 2.4650 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 5.3620 3.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 5.7630 4.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 4.5170 4.8480 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4640 4.1400 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 4.7620 5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 4.3840 7.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 3.2280 6.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 3.4860 5.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -0.2140 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 1.2280 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.1080 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.4840 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.0490 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 1.5830 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 3.2350 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 3.4380 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 3.2810 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 3.4500 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 6.6800 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 5.0520 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 7.8120 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 9.0820 4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2920 5.4390 4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8180 8.5060 7.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1710 7.9880 8.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8950 10.0340 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2730 10.4450 7.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 4.5250 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 6.5070 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 6.2110 5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 4.0760 5.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 5.7820 5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.1160 7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 5.2150 7.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 2.2840 6.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 3.1170 7.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 1.5430 1.9920 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4040 1.1900 1.8570 H 0 0 0 0 0 0 0 0 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 1 61 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 61 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 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 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END