RDKit 3D 93 97 0 0 0 0 0 0 0 0999 V2000 -4.5188 0.8509 3.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8307 1.6299 1.8855 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7898 2.4435 2.6185 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8578 2.4327 1.4039 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3344 0.6240 0.9328 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3086 -0.2594 1.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2095 -1.3891 0.7222 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7979 -2.3955 0.9912 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3824 -1.1118 -0.4743 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8598 -2.2031 -1.4903 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7312 0.2635 -1.0259 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5973 1.1735 -1.2566 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 0.6575 -0.8887 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9338 -0.7931 -1.3430 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5568 -1.0679 -2.7283 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3801 -1.1271 -1.1377 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8391 -1.1150 0.1452 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6749 -0.0763 0.4424 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2483 0.6670 1.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9753 1.7916 1.7906 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6675 2.8833 0.7938 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2987 3.1957 0.8813 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4483 1.5670 1.8897 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7747 0.9865 3.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9429 0.6705 0.7935 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8008 1.3404 -0.4198 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0971 -0.5841 0.7714 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5702 -1.3963 -0.2509 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9699 -2.1368 -2.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0632 -3.5112 -1.9613 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7137 -3.9671 -3.1055 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0085 -2.9727 -3.8559 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6003 -1.8887 -3.2918 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -1.4261 -0.2564 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7056 -1.0013 0.9873 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6059 -2.3273 0.6955 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0242 -3.1116 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1501 -4.3934 1.7891 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6821 -2.6032 2.8251 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9927 0.9134 -0.4530 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6453 2.4498 -0.5346 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1067 0.8763 -1.4778 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1042 1.8492 -1.1414 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8627 -0.2976 -1.8232 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6877 -0.9318 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6013 -0.3015 -0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5059 -2.2591 -0.4446 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3729 1.4441 3.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8006 0.6486 3.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9456 -0.0619 2.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8882 3.5254 2.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7624 2.1192 2.5131 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9528 2.4465 3.7447 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0685 3.0972 2.1193 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2004 -0.1293 0.8712 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3409 0.2438 1.7633 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7563 -0.5529 2.6358 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2404 -3.0840 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8896 -2.5646 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9884 -1.8061 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0942 0.0111 -2.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6298 2.1634 -0.7458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 1.4760 -2.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 1.2501 -1.3683 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8848 0.7377 0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4303 -0.8848 -3.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2098 -0.4000 -3.1942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2938 -2.1087 -2.9647 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8899 -0.1378 -1.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8478 0.6180 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 2.1511 2.8028 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2353 3.7875 1.1249 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9291 2.6180 -0.2223 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1932 3.8485 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9924 2.5529 1.8742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9681 1.0495 3.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0194 0.3886 0.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6199 1.8201 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0758 -1.1041 1.7269 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8670 -0.8494 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -4.1447 -1.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9196 -5.0006 -3.2959 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -0.9094 -3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4948 -2.9462 0.2763 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2899 -1.9170 3.4502 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3267 2.7072 -1.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0828 2.8001 0.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6318 3.0144 -0.4711 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6476 1.3590 -2.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7347 1.9533 -1.8703 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6489 0.0570 -2.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3381 -1.0719 -2.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3568 -2.8327 -0.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 6 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 6 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 16 29 1 0 29 33 2 0 33 32 1 0 32 31 1 0 31 30 2 0 14 34 1 0 34 35 1 1 35 36 1 0 36 37 1 0 37 39 1 0 37 38 2 0 11 40 1 0 40 41 1 1 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 47 1 0 45 46 2 0 40 5 1 0 34 9 1 0 36 34 1 0 27 18 1 0 30 29 1 0 1 48 1 0 1 49 1 0 1 50 1 0 3 51 1 0 3 52 1 0 3 53 1 0 4 54 1 0 5 55 1 6 6 56 1 0 6 57 1 0 10 58 1 0 10 59 1 0 10 60 1 0 11 61 1 6 12 62 1 0 12 63 1 0 13 64 1 0 13 65 1 0 15 66 1 0 15 67 1 0 15 68 1 0 16 69 1 6 18 70 1 6 20 71 1 1 21 72 1 0 21 73 1 0 22 74 1 0 23 75 1 6 24 76 1 0 25 77 1 1 26 78 1 0 27 79 1 1 28 80 1 0 33 83 1 0 31 82 1 0 30 81 1 0 36 84 1 6 39 85 1 0 41 86 1 0 41 87 1 0 41 88 1 0 42 89 1 6 43 90 1 0 44 91 1 0 44 92 1 0 47 93 1 0 M END