PUBCHEM-ZINC06546570 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 69 0 0 1 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.8960 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.6460 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -4.1100 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -6.1490 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2990 -6.4730 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -6.6170 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -8.1310 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -8.6860 2.6430 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -10.4750 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 -6.7280 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -7.9630 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -8.5960 -0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 -8.5580 -0.4730 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2600 -8.3070 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5700 -7.9930 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9900 -8.4920 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9370 -7.7680 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2390 -8.2240 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5960 -9.4080 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6440 -10.1320 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3440 -9.6690 -2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8760 -9.8580 -1.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6710 -10.0140 -0.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -10.5580 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 -9.8410 -2.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -11.8970 -1.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 -12.4130 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 -11.9010 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 -13.9420 -2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 -11.9400 -4.2390 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 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.3250 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -6.1180 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -6.3720 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -8.6310 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -8.3770 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -10.9160 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -10.6620 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -10.9220 3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -6.2220 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5650 -6.9040 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -8.3180 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6590 -6.8470 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9790 -7.6590 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9190 -11.0540 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6040 -10.2300 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4470 -9.5390 -2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 -10.5870 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -12.2380 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -12.2880 -3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -10.8110 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -14.3070 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -14.3300 -3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -14.2800 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 -10.8500 -4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 -12.3270 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1650 -12.3040 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 36 69 1 0 0 0 0 M END