IBS-ZINC01799813 MOE2007 3D Structure written by MMmdl. 43 46 0 0 0 0 0 0 0 0999 V2000 -5.0110 5.3100 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 3.9300 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 3.3040 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 4.0660 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 5.4580 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 6.0720 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 3.4030 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 4.1730 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 3.5540 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 4.2140 0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 2.0840 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 1.3880 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 0.0080 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -0.6830 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0010 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.3830 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 2.0640 0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.0390 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -2.6680 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -2.9830 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -3.6220 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -3.9470 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -3.6340 0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -2.9900 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -2.6490 2.3360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2700 -2.9320 3.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -2.0850 2.4440 O 0 5 0 0 0 0 0 0 0 0 0 0 6.1670 -4.6320 -0.5130 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6020 -4.9090 -1.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 -4.9190 0.4840 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6050 2.0650 0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9760 5.7960 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 3.3420 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 2.2270 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 6.0540 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 7.1480 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 5.2480 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -0.5360 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -0.5480 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -2.7300 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -3.8680 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -3.8880 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 2.3050 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 43 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M CHG 1 28 1 M CHG 1 30 -1 M END