PUBCHEM-ZINC04544546 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 59 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3920 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9100 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -2.2370 -2.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2190 -1.7460 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -3.7280 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -4.3840 -2.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -4.3320 -3.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -5.7820 -3.9350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1970 -6.2660 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -6.1000 -5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -5.7020 -5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -6.6120 -4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -6.2470 -4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -4.9730 -5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -4.0640 -5.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -4.4300 -5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -6.2910 -3.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -5.5190 -3.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -7.6040 -4.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -8.0990 -4.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0880 -7.3530 -4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -9.3990 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -9.1120 -6.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -10.6530 -7.2740 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -10.1180 -8.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -8.3580 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -8.1500 -1.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -1.7600 -2.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -2.2320 -1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -3.0520 -1.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.0240 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.0400 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.3260 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3420 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -3.8080 -3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -7.1690 -5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -5.5460 -6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -7.6070 -4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -6.9570 -4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 -4.6870 -5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -3.0680 -5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -3.7210 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -8.2220 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -10.1150 -4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -9.8140 -4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -8.3960 -6.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -8.6970 -6.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -9.3770 -9.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -9.6780 -8.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -10.9770 -9.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -1.1040 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -1.8800 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -8.8190 -2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -8.9700 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 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 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 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 47 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 58 59 1 0 0 0 0 M END