RDKit 3D 49 53 0 0 0 0 0 0 0 0999 V2000 1.7680 -1.4127 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7256 -0.2815 1.3306 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0877 0.8097 2.3740 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3925 2.1521 2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4257 2.7628 3.5575 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6612 3.5587 3.8401 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7167 3.2588 4.7517 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6228 4.2880 4.6581 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2004 5.2074 3.7554 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0125 4.7680 3.2706 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2937 1.6378 4.4361 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 0.5039 3.8014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7891 -0.5825 4.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -0.8252 1.5144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1653 -1.6772 0.3303 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6098 -1.7690 0.3862 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1574 -0.7724 -0.3745 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3272 -0.4488 -0.4142 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0401 -0.1576 -1.1211 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0264 1.0850 -1.6157 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7648 1.6972 -2.1478 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4097 0.7153 -2.2733 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4753 -0.3203 -1.1242 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5382 -1.2160 -1.4214 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 0.3959 0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8677 -1.0799 -1.0357 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0017 -2.1604 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5361 -2.2516 0.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8341 -1.8259 2.4374 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7609 -1.0494 1.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1718 0.9885 2.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6518 2.0109 1.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8735 2.7663 1.4016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4486 3.4079 3.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8017 2.3988 5.4033 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5642 4.5053 5.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 5.4130 2.5374 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4044 0.0015 1.6541 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7841 -1.4253 2.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7619 -2.6924 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9196 1.7049 -1.5675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9623 2.1466 -3.1276 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4782 2.5154 -1.4756 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3491 0.1961 -3.2384 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3425 1.2934 -2.3121 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3016 -0.6652 -1.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2362 -2.9360 -2.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9731 -2.6685 -2.1011 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8999 -1.7336 -3.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 17 18 2 0 26 15 1 0 12 11 1 0 11 5 1 0 21 22 1 0 20 19 2 0 19 26 1 0 26 23 1 0 15 14 1 0 14 2 1 0 2 25 1 0 25 23 1 0 23 22 1 0 23 24 1 6 2 3 1 0 5 4 1 0 5 6 1 0 6 10 2 0 19 17 1 0 4 3 1 0 15 16 1 0 21 20 1 0 10 9 1 0 9 8 1 0 8 7 2 0 7 6 1 0 26 27 1 6 12 13 2 0 17 16 1 0 3 31 1 1 3 12 1 0 2 1 1 6 5 34 1 6 4 32 1 0 4 33 1 0 21 42 1 0 21 43 1 0 20 41 1 0 22 44 1 0 22 45 1 0 27 47 1 0 27 48 1 0 27 49 1 0 15 40 1 6 14 38 1 0 14 39 1 0 24 46 1 0 10 37 1 0 8 36 1 0 7 35 1 0 1 28 1 0 1 29 1 0 1 30 1 0 M END