RDKit 3D 84 89 0 0 0 0 0 0 0 0999 V2000 8.3826 0.8616 -2.6102 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 1.3515 -1.6887 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2364 0.7123 -1.7682 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2424 1.7782 -2.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1483 1.7265 -1.1892 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7971 2.6986 -0.5945 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4996 0.4142 -0.9660 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1469 -0.1129 -2.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 0.5930 -0.1015 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2300 1.2912 -0.8881 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0688 1.4416 -0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5419 0.1362 0.4123 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7858 -0.9177 -0.5904 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6121 -0.3784 1.2750 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0787 -1.4650 2.0248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -1.1146 2.0296 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0616 -1.1418 3.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9899 -2.0635 3.8242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4042 -1.9774 5.2474 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4243 -2.9127 3.0216 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5515 0.2720 1.5193 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7276 1.0560 1.2954 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5787 1.0475 2.5801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6806 0.8581 0.1875 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3875 -0.4288 0.0758 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3757 -0.3749 -1.0434 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6405 -1.6267 -1.8412 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 0.7189 -1.3353 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9894 0.8136 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2337 -0.3101 -3.1483 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6856 1.9462 -0.5561 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 3.0300 -0.8297 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7286 1.8285 0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7885 -0.7389 0.4615 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8616 -1.3239 1.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2021 -1.3789 0.6779 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3046 -1.8483 -0.6294 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5204 -0.4813 -0.3492 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9279 0.0461 -0.4622 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7759 -1.0742 -0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0672 0.9706 -3.6616 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3081 1.4815 -2.5048 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7048 -0.1798 -2.3633 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3063 -0.0292 -2.5626 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8086 1.5298 -3.1636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6835 2.7957 -2.1968 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9985 -0.6248 -2.8136 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8678 0.7460 -2.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -0.8014 -2.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5558 1.2126 0.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 2.3200 -1.0961 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1235 0.8136 -1.8862 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1355 2.1151 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7832 1.9233 -0.8171 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0249 -0.8171 -1.3733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7155 -0.8322 -1.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7509 -1.9515 -0.1953 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8937 0.4759 1.9327 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1127 -2.4732 1.6477 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2525 -1.3784 3.0859 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0243 -1.8815 1.3933 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2909 -0.9643 5.6526 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.6970 5.8428 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4799 -2.2943 5.3719 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9785 0.8352 2.3381 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4055 2.1431 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2725 0.2135 2.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1094 2.0374 2.6654 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9054 1.0292 3.4739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2988 1.1375 -0.8119 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0033 -0.6837 0.9755 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7652 -1.3206 -0.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9993 -2.4546 -1.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3657 -1.5457 -2.8888 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6653 -1.9546 -1.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6016 1.5970 -3.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9538 1.1906 -1.9668 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4971 -0.1089 -4.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6478 -1.4383 -0.3613 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5588 -2.3630 1.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9499 -0.7701 2.2819 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0069 -1.7617 1.3393 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1655 0.6787 0.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9928 -1.3166 0.5456 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 1 0 5 6 2 0 5 7 1 0 7 8 1 6 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 6 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 2 0 16 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 2 0 28 29 1 0 29 30 1 0 28 31 1 0 31 32 2 0 31 33 1 0 14 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 38 37 1 6 38 39 1 0 39 40 1 0 39 3 1 0 38 7 1 0 34 9 1 0 38 36 1 0 21 12 1 0 33 24 1 0 1 41 1 0 1 42 1 0 1 43 1 0 3 44 1 6 4 45 1 0 4 46 1 0 8 47 1 0 8 48 1 0 8 49 1 0 9 50 1 1 10 51 1 0 10 52 1 0 11 53 1 0 11 54 1 0 13 55 1 0 13 56 1 0 13 57 1 0 14 58 1 1 15 59 1 0 15 60 1 0 16 61 1 6 19 62 1 0 19 63 1 0 19 64 1 0 21 65 1 1 22 66 1 6 23 67 1 0 23 68 1 0 23 69 1 0 24 70 1 6 25 71 1 0 25 72 1 0 27 73 1 0 27 74 1 0 27 75 1 0 29 76 1 0 29 77 1 0 30 78 1 0 34 79 1 6 35 80 1 0 35 81 1 0 36 82 1 1 39 83 1 1 40 84 1 0 M END