PUBCHEM-ZINC03648667 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 67 0 0 1 0 0 0 0 0999 V2000 2.0500 1.1900 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 0.1290 -0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.3540 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 0.1650 2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -0.5990 3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -1.8470 3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.3630 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -1.6040 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.8110 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.6060 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.3870 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -1.4330 -3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -0.8770 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -1.4110 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -0.5790 -7.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 0.7920 -6.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 1.3570 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.5100 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 0.7860 -3.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 2.1090 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 2.1430 -1.7740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7410 1.2920 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 3.4510 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 2.8390 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 5.0600 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 2.1000 -2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 1.3100 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.2340 -8.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -0.4540 -9.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -2.6830 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.8540 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -4.2460 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -4.7730 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -4.8350 -2.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -3.9710 -3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -4.2130 -4.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 1.2040 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 2.1370 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 0.9910 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 1.1260 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.2220 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -2.4360 4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -3.3440 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -2.4810 -6.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 1.4630 -7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 2.4320 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 2.4160 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 2.8170 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 3.4710 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 4.3040 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 3.2390 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 1.7890 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 2.9410 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 5.5370 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 5.5390 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 5.0880 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -1.1310 -10.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 0.2780 -9.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 0.0330 -9.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -5.8070 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 3.6270 -0.5640 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7300 3.1930 -1.3730 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 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 30 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 61 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 61 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END