PUBCHEM-ZINC04425634 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 68 0 0 1 0 0 0 0 0999 V2000 -4.7700 0.5920 -4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 -0.7350 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -1.0540 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -2.3820 -3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -2.6960 -4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -1.9330 -5.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -3.8240 -3.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -4.7580 -2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -6.1480 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -6.4680 -4.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -5.5350 -5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -4.1470 -4.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1140 -3.4080 -5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -4.1440 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -7.5970 -3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -7.8840 -4.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -8.5020 -2.8590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6830 -8.3710 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -8.1490 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -6.7410 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -9.1550 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -9.8960 -3.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -10.8880 -2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -10.6270 -1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -12.3220 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -13.2410 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -14.6970 -2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -15.6160 -2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -17.0720 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 1.3870 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 0.5150 -5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 0.8190 -3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -0.6580 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -1.5300 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -1.1310 -5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -0.2590 -3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -2.3050 -2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -3.1770 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -4.8000 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -4.4230 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -6.8880 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -6.1500 -4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -5.8700 -5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -5.4920 -6.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -4.8880 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -4.3830 -4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -3.1570 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -8.1850 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -6.6780 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -6.5280 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -6.0140 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -10.1580 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -8.9040 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -9.1200 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -10.1040 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -12.4540 -4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -12.5710 -2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -13.1090 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -12.9910 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -14.8290 -3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -14.9460 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -15.4840 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -15.3660 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -17.2040 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -17.3210 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -18.9220 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -17.9540 -1.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -17.8040 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 52 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 55 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 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 29 67 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 M END