ENAMINE-ZINC05269030 MOE2007 3D Structure written by MMmdl. 53 55 0 0 1 0 0 0 0 0999 V2000 0.5280 3.6760 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 3.1330 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 3.7140 1.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 1.9270 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 1.2180 0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1080 1.9770 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 0.3180 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 1.1010 -2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 2.3220 -2.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 0.2880 -3.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 0.8940 -4.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 0.1040 -5.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -1.1170 -5.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 0.8770 -7.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.1820 -8.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.2500 -9.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.2270 -10.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.2620 -11.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.2550 -11.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -2.2610 -10.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -1.2270 -9.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -0.9160 -8.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 -1.7120 -8.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 0.3950 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -0.6590 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -1.4060 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -1.1070 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -0.0580 3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 0.6900 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 4.7320 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 3.1170 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 3.5870 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 1.5170 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.3100 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -0.3510 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -0.7280 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 1.9060 -4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 0.9440 -7.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 1.8800 -7.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 0.5410 -10.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.3010 -12.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -3.0400 -12.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -3.0210 -10.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -1.9250 -9.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -2.6480 -8.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -1.1730 -8.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -0.9050 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -2.2210 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -1.6870 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 0.1830 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 1.5130 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 0.5880 -8.8900 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9960 1.4030 -8.6040 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 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 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 22 1 0 0 0 0 15 52 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 16 52 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END