ENAMINE-ZINC04997695 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -4.6300 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8430 -4.8560 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -4.6460 -2.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -5.3650 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -5.6300 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2430 -6.1040 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 -6.3220 -0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0950 -6.0700 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -5.5860 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -5.3250 1.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -4.8760 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -4.5700 2.6990 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -5.0490 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -4.8650 5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -4.4510 5.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -5.1610 6.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9070 -4.9970 7.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -4.5810 7.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 -5.2930 8.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -5.1140 10.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -5.5130 11.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -6.4130 11.9640 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5370 -5.4630 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8220 -6.3100 -2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8140 -6.6960 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 -6.2450 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -4.4250 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -6.0950 3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -5.4930 6.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 -5.6240 8.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2470 -5.7380 10.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -4.0680 10.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -5.0560 11.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 -6.8690 11.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6430 -6.6990 12.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 17 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 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 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END