PUBCHEM-ZINC03121537 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8060 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 -1.7290 -0.3340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -1.6450 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -1.8570 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -0.8060 0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 0.4290 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 0.6680 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 1.7870 0.0600 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 3.1650 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 4.4690 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8250 4.4670 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 5.6370 0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 6.8490 0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 7.9740 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 9.2500 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 10.4620 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 11.6520 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1220 11.6460 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8160 10.4490 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 9.2520 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -3.4940 0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9960 -3.1280 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1830 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1670 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1570 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -2.4770 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 3.1030 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 3.1120 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 5.6380 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 7.9750 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 10.4680 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 12.5900 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6630 12.5810 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 10.4520 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 8.3180 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -2.5560 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2570 -2.5460 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 -4.0610 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END