RDKit 3D 47 47 0 0 0 0 0 0 0 0999 V2000 5.8768 -1.0857 1.6919 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3603 -1.4542 0.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9672 -0.2131 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9201 0.5522 0.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7516 0.8030 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2615 0.3688 -1.6131 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0424 -0.5097 -1.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0312 0.2163 -0.7494 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0242 0.3363 0.4806 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1964 0.8249 -1.4354 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7601 1.8699 -2.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1317 1.3766 -0.4511 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0853 2.6616 -0.3449 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0401 0.6916 0.3657 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8785 1.4273 1.3439 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0709 0.5918 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9793 -0.5058 0.5985 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4479 -0.6640 0.5311 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0536 -1.6356 -0.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5852 -2.9061 -0.1642 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9258 -1.4292 1.7743 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3291 -1.5772 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8902 0.0099 1.8638 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1459 -1.9566 -0.2495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4512 -2.0815 0.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8730 0.4504 -0.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6859 -0.4628 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1054 0.9666 1.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0368 1.4036 0.3085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9974 -0.0973 -2.2639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8536 1.3174 -2.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7119 -0.9103 -2.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3594 -1.4030 -0.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6623 0.0119 -2.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6813 2.2899 -2.9251 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1203 2.6515 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2063 1.3935 -3.2859 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2452 1.6129 2.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2126 2.3812 0.8796 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0272 1.1565 1.5592 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9695 0.1156 2.6546 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3381 -0.0661 -0.3601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4807 -1.4302 0.8761 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1197 -1.0088 1.5418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9682 -1.8006 -0.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5001 -1.4113 -1.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7779 -2.8719 0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 18 14 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 10 34 1 6 11 35 1 0 11 36 1 0 11 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 18 44 1 1 19 45 1 0 19 46 1 0 20 47 1 0 M END