RDKit 3D 83 86 0 0 0 0 0 0 0 0999 V2000 9.5772 0.6126 2.6921 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1879 0.5480 1.4137 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4865 0.2827 0.2559 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 0.0574 0.2384 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4143 -0.2100 -0.9143 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9832 -0.4327 -0.8278 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 -0.6975 -1.8473 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7775 -0.9009 -1.6373 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9668 -1.1577 -2.5668 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2662 -0.8146 -0.3672 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9333 -0.9813 0.0115 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9224 -1.9867 1.1639 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6272 -3.1319 0.8506 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -1.1292 2.1803 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5373 -1.6843 3.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0537 -3.0005 3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 0.1439 2.0443 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5567 0.2766 0.7994 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1601 1.4967 0.1687 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6965 1.8171 -1.0771 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2232 0.3505 1.0906 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6557 0.4845 0.0610 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4468 -0.6978 0.0334 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7612 -0.4376 -0.2779 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4464 -1.6695 -0.7793 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7956 -1.4026 -1.0979 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7417 -0.9518 -0.2116 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3962 -0.7580 0.9824 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1403 -0.6922 -0.6241 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9844 -0.2583 0.2937 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3646 0.0155 -0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9204 -0.1429 -1.2819 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2503 0.1370 -1.5528 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0261 0.5905 -0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3590 0.8891 -0.7199 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4993 0.7604 0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1786 0.4776 0.9858 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8214 0.5858 -1.4192 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0879 0.6089 -1.9902 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5041 1.9321 -0.8066 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6843 2.4813 -0.3096 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 1.6820 0.3321 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7462 2.7928 0.4951 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1378 -0.2429 -2.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5194 -0.0153 -2.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1882 0.2449 -0.9258 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5578 0.4713 -0.9192 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3886 0.8541 3.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0613 -0.3460 2.9428 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8616 1.4719 2.7524 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6037 0.0947 1.1943 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5197 -0.3776 0.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6412 -0.7580 -2.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2342 -1.2044 -0.7784 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8803 -2.1980 1.4903 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0508 -3.8040 0.4443 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7294 -1.1486 1.8677 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5191 -1.6742 3.9592 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2252 -1.1135 4.2228 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0204 -2.9457 3.3339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0678 2.3286 0.8963 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2612 1.3006 0.0743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9286 2.7620 -1.2602 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2371 0.5474 -0.9513 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2405 0.0054 0.5933 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3712 -2.5200 -0.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9487 -1.9547 -1.7498 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3898 -0.8728 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6306 -0.1044 1.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2998 -0.5020 -2.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6597 0.0007 -2.5492 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6798 1.8144 -0.9955 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1359 1.1254 1.5492 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7956 0.6210 1.9839 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0224 0.3561 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0536 0.8174 -2.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1027 2.6269 -1.5568 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5557 3.4185 -0.0164 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0899 1.5099 1.3094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0816 3.5909 0.0068 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6224 -0.4484 -3.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0149 -0.0595 -3.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0604 0.4426 -1.7835 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 14 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 18 21 1 1 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 34 36 1 0 36 37 2 0 24 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 5 44 2 0 44 45 1 0 45 46 2 0 46 47 1 0 46 3 1 0 18 11 1 0 42 22 1 0 37 31 1 0 1 48 1 0 1 49 1 0 1 50 1 0 4 51 1 0 6 52 1 0 7 53 1 0 11 54 1 6 12 55 1 1 13 56 1 0 14 57 1 6 15 58 1 0 15 59 1 0 16 60 1 0 19 61 1 0 19 62 1 0 20 63 1 0 22 64 1 6 24 65 1 1 25 66 1 0 25 67 1 0 29 68 1 0 30 69 1 0 32 70 1 0 33 71 1 0 35 72 1 0 36 73 1 0 37 74 1 0 38 75 1 6 39 76 1 0 40 77 1 6 41 78 1 0 42 79 1 1 43 80 1 0 44 81 1 0 45 82 1 0 47 83 1 0 M END