RDKit 3D 85 91 0 0 0 0 0 0 0 0999 V2000 -2.4033 1.4843 3.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 1.7206 1.9857 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2516 0.6357 1.0462 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0927 0.8497 -0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8687 0.0575 -1.2990 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1910 0.8528 -2.5436 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4292 1.3499 -2.6753 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5181 0.5574 -2.7397 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6549 -1.2176 -1.3245 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7249 -2.4221 -1.0573 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9789 -2.0802 0.2041 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8298 -1.6315 1.2081 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7069 -2.4180 2.3662 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9953 -1.0064 -0.1476 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6690 -1.6356 -0.3941 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0235 -2.2816 0.7784 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4791 -2.0092 0.6457 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8638 -0.8617 1.5456 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2145 -0.6054 1.3305 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9901 -0.9291 2.4657 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0371 0.3559 1.3731 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3793 0.5445 0.0515 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0852 1.5709 -0.6276 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0275 1.0744 0.1996 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6842 1.1299 -1.1898 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3638 -0.2145 -1.3835 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9666 0.1039 0.8765 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3757 -0.6300 -0.8566 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6142 -1.4842 -0.7786 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8067 -0.7668 -0.8869 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7778 -1.0365 -1.8487 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5252 -1.9817 -2.6371 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0192 -0.2906 -1.9628 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3586 0.7085 -1.1812 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5921 1.4751 -1.2684 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7785 2.5047 -0.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8929 3.2915 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8651 3.0422 -1.2705 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6954 2.0277 -2.1883 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5664 1.2366 -2.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4359 0.4438 3.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3963 1.8805 3.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8452 2.0963 4.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3672 1.7051 2.4073 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1686 2.7038 1.5439 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1819 1.9604 -0.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 0.5914 0.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3992 1.5985 -2.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0587 0.0896 -3.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5404 -0.1708 -3.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4107 1.2331 -2.9916 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7792 0.1354 -1.7659 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -1.2732 -0.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1255 -1.4681 -2.2854 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 -3.3185 -0.8791 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9858 -2.5319 -1.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4254 -2.9582 0.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9685 -3.4727 2.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3427 -2.0203 3.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6589 -2.3958 2.7442 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7903 -2.3902 -1.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3237 -1.9075 1.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -3.3957 0.7988 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0903 -2.8785 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7825 -1.2653 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8477 -1.9974 2.6671 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0265 -0.6135 2.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5143 -0.3853 3.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 1.2400 1.6245 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2816 0.3685 2.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9901 2.3736 -0.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9934 2.0600 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9404 1.3419 -1.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3595 1.9812 -1.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0822 -0.7019 -2.3197 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5951 -0.3133 1.8092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2396 -0.3293 -1.8984 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5095 -2.2885 -1.5277 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7102 -0.5707 -2.7369 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6416 0.9644 -0.4141 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0164 2.7248 0.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0005 4.0940 0.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7650 3.6643 -1.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4903 1.8689 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4376 0.4562 -2.9077 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 1 6 6 7 1 0 7 8 1 0 5 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 14 11 1 1 14 15 1 0 15 16 1 0 16 17 1 0 17 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 2 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 29 28 1 0 28 22 1 0 22 23 1 6 22 21 1 0 21 18 1 0 18 19 1 0 19 20 1 0 22 24 1 0 24 25 1 0 25 26 1 0 24 27 1 0 27 3 1 0 26 5 1 0 26 14 1 0 27 14 1 0 28 15 1 0 18 17 1 0 40 35 1 0 1 41 1 0 1 42 1 0 1 43 1 0 2 44 1 0 2 45 1 0 4 46 1 0 4 47 1 0 6 48 1 0 6 49 1 0 8 50 1 0 8 51 1 0 8 52 1 0 9 53 1 0 9 54 1 0 10 55 1 0 10 56 1 0 11 57 1 1 13 58 1 0 13 59 1 0 13 60 1 0 15 61 1 6 16 62 1 0 16 63 1 0 17 64 1 6 29 78 1 6 33 79 1 0 34 80 1 0 36 81 1 0 37 82 1 0 38 83 1 0 39 84 1 0 40 85 1 0 28 77 1 6 23 71 1 0 21 69 1 0 21 70 1 0 18 65 1 1 20 66 1 0 20 67 1 0 20 68 1 0 24 72 1 1 25 73 1 0 25 74 1 0 26 75 1 6 27 76 1 1 M END