RDKit 3D 114119 0 0 0 0 0 0 0 0999 V2000 3.4228 0.0595 3.3182 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5781 0.2126 1.8689 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 1.2063 1.4305 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0706 -0.6537 0.9112 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -0.4698 -0.4586 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0076 -1.6404 -1.0933 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7542 -2.2766 -0.1647 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1145 -2.2675 -0.3367 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8228 -1.7712 0.7752 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0973 -1.3966 0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7406 -2.4418 -0.5125 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6560 -2.0319 -1.8402 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0432 -3.7721 -0.3956 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5303 -4.6267 -1.3896 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5595 -3.7046 -0.5011 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9258 -4.5329 0.4313 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0935 -2.5083 -1.9130 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1185 -3.1699 -1.2422 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4571 -1.6359 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2941 -0.3182 -2.5574 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9303 -0.2635 -1.2188 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3675 0.9440 -0.8928 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1038 0.8143 -0.3782 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1696 1.2168 1.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3073 1.3787 1.4853 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9022 0.1556 2.0588 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8993 -0.9017 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6209 -2.0665 3.0903 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8777 -2.3605 2.8619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5646 -3.5432 3.4969 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8698 -3.1086 4.1213 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6699 -4.2551 4.3048 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6576 -2.1683 3.2767 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8247 -0.9714 2.8613 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7251 -1.5450 1.9664 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4444 -2.3765 0.9166 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9571 -0.4912 1.2260 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9449 0.6239 0.8977 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2498 1.4916 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 1.9582 0.2434 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0082 3.4673 0.5082 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9597 1.6946 -0.9211 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6266 0.9393 -1.9242 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4047 2.8710 -1.6117 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4526 2.3263 -2.7803 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3657 3.7765 -2.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3603 4.9463 -2.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3333 3.3014 -3.2928 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1741 4.3878 -3.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0374 5.1360 -2.9046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7794 6.1891 -3.7596 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0955 4.3092 -2.2526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9326 -0.9101 3.5349 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7303 0.8463 3.6878 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3656 0.1752 3.8928 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 0.4605 -0.5932 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6911 -1.1809 -1.8403 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4319 -1.7365 -1.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7221 -1.1710 1.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9978 -0.4640 -0.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8152 -2.5261 -0.2791 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7038 -2.8273 -2.4591 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3918 -4.2150 0.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2375 -5.5712 -1.2064 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2446 -4.0414 -1.5148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8457 -4.0780 1.3172 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7202 -3.2318 -2.4479 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4169 -3.8761 -0.6319 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0602 -1.5985 -3.9188 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -2.0276 -3.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1905 -1.0588 -0.9619 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1557 -0.2838 -0.4375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7234 2.1725 1.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6941 0.4600 1.6595 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2541 2.1438 2.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4364 0.3970 3.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2921 -1.3099 1.6814 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2817 -0.4774 3.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0628 -2.7066 3.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9218 -3.9858 4.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7824 -4.3462 2.7767 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6776 -2.6746 5.1262 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2849 -4.3591 3.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5251 -1.8186 3.8773 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0878 -2.6983 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3948 -0.5369 3.7962 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4687 -0.2905 2.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7746 -2.4101 0.0144 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6188 -3.4133 1.2003 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -1.8646 0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5683 -0.9748 0.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 1.2003 1.8136 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8554 0.2244 0.4275 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3056 0.9179 -1.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9729 2.3457 -0.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 3.5470 1.6023 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0463 3.9711 0.4831 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8459 3.9305 -0.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 0.0015 -1.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2955 3.4084 -0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1748 2.8581 -3.7464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5243 2.4089 -2.5886 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2001 1.2741 -2.9936 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8523 2.6716 -4.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0445 2.5846 -2.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8568 3.9933 -4.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5683 5.1652 -4.4081 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5102 5.7379 -2.1461 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 6.5577 -3.1874 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0885 7.0087 -4.0663 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1171 5.7046 -4.7018 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1105 4.5855 -2.6078 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0946 4.5467 -1.1577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9072 3.2296 -2.3228 H 0 0 0 0 0 0 0 0 0 0 0 0 51 50 1 0 50 52 1 0 50 49 1 0 49 48 1 0 48 46 1 0 46 47 2 0 46 44 1 0 44 45 1 0 44 42 1 0 42 43 1 6 42 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 34 35 1 0 35 36 1 6 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 1 23 22 1 0 22 21 1 0 21 20 1 0 20 19 1 0 19 17 1 0 17 18 1 0 17 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 40 42 1 0 5 21 1 0 40 25 1 0 15 8 1 0 37 26 1 0 35 29 1 0 51109 1 0 51110 1 0 51111 1 0 50108 1 0 52112 1 0 52113 1 0 52114 1 0 49106 1 0 49107 1 0 48104 1 0 48105 1 0 44100 1 1 45101 1 0 45102 1 0 45103 1 0 43 99 1 0 23 72 1 1 24 73 1 0 24 74 1 0 25 75 1 1 26 76 1 1 27 77 1 0 27 78 1 0 28 79 1 0 30 80 1 0 30 81 1 0 31 82 1 1 32 83 1 0 33 84 1 0 33 85 1 0 34 86 1 0 34 87 1 0 36 88 1 0 36 89 1 0 36 90 1 0 37 91 1 6 38 92 1 0 38 93 1 0 39 94 1 0 39 95 1 0 41 96 1 0 41 97 1 0 41 98 1 0 21 71 1 6 19 69 1 0 19 70 1 0 17 67 1 6 18 68 1 0 6 57 1 6 8 58 1 6 10 59 1 0 10 60 1 0 11 61 1 1 12 62 1 0 13 63 1 1 14 64 1 0 15 65 1 6 16 66 1 0 5 56 1 1 1 53 1 0 1 54 1 0 1 55 1 0 M END