RDKit 3D 85 89 0 0 0 0 0 0 0 0999 V2000 -5.4847 2.8512 2.1548 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7328 3.3848 0.9697 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4502 2.3011 0.0953 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6955 1.2094 0.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2331 1.1345 1.6399 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4754 0.1307 -0.5415 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7463 0.8920 -1.6656 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6365 1.6742 -0.9336 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6828 0.6075 -0.5047 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1132 -0.6492 -0.4743 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2093 -1.7795 -0.8747 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2335 -1.3978 -0.7471 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5701 0.0357 -1.0041 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7465 0.9063 -0.1270 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8913 2.3688 -0.1732 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0578 0.4710 1.3005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5297 0.4007 1.5502 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4226 0.8136 0.4414 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0697 0.2152 -0.8940 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4613 1.1530 -2.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7712 -1.0992 -1.1478 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2445 -1.0832 -0.9222 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0002 -0.4786 -1.8955 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4907 -0.6429 0.4767 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8589 -0.5289 0.6798 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 0.6510 0.8595 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7355 1.7554 0.2523 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 0.8081 2.3273 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5481 1.8525 2.8178 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5865 -0.1123 3.2733 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5205 -0.8876 -0.0432 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8492 -2.3200 -0.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3275 -2.5487 -0.0953 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8057 -2.2240 1.2754 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5855 -4.0174 -0.3642 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0217 -1.7595 -1.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7794 -0.2831 -1.0643 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5701 3.0957 1.9986 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1129 3.3383 3.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4029 1.7612 2.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3303 4.1161 0.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 3.8871 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2311 0.1895 -2.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 1.5866 -2.1838 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0278 2.2780 -0.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2055 2.2871 -1.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4552 -2.6292 -0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4793 -2.1160 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -1.7554 0.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7459 -1.9888 -1.5656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2287 0.2383 -2.0641 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1003 2.9250 -0.2547 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2442 2.8217 0.8089 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4966 2.7975 -0.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5514 1.2158 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5434 -0.5057 1.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7483 1.0505 2.4281 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8529 -0.6325 1.8754 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3467 1.9315 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9094 2.0947 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 1.4034 -2.6968 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1769 0.6845 -2.7434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4127 -1.8932 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5932 -1.4014 -2.1948 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5670 -2.1723 -0.9483 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9193 -0.8109 -1.8454 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1177 -1.4479 1.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3034 -1.3289 0.2567 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3009 2.7488 0.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6742 1.7306 0.8796 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0534 1.5409 -0.7603 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0826 -0.9434 3.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5065 -0.7846 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5746 -2.7069 -1.2842 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3006 -2.9389 0.4583 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0022 -2.1025 2.0282 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3477 -1.2374 1.2106 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4705 -3.0301 1.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9673 -4.4086 -1.1892 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3483 -4.6220 0.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6715 -4.1625 -0.5362 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0999 -2.0174 -1.1225 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6606 -2.1584 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9979 0.1488 -2.0767 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6237 0.1186 -0.4257 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 2 0 6 4 1 1 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 19 1 0 19 20 1 6 19 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 26 18 1 0 18 17 1 0 17 16 1 0 16 14 1 0 14 15 1 1 26 28 1 1 28 30 1 0 28 29 2 0 10 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 33 36 1 0 36 37 1 0 31 6 1 0 37 6 1 0 14 9 1 0 14 13 1 0 18 19 1 0 1 38 1 0 1 39 1 0 1 40 1 0 2 41 1 0 2 42 1 0 7 43 1 0 7 44 1 0 8 45 1 0 8 46 1 0 11 47 1 0 11 48 1 0 12 49 1 0 12 50 1 0 13 51 1 6 20 60 1 0 20 61 1 0 20 62 1 0 21 63 1 0 21 64 1 0 22 65 1 1 23 66 1 0 24 67 1 1 25 68 1 0 27 69 1 0 27 70 1 0 27 71 1 0 18 59 1 6 17 57 1 0 17 58 1 0 16 55 1 0 16 56 1 0 15 52 1 0 15 53 1 0 15 54 1 0 30 72 1 0 31 73 1 1 32 74 1 0 32 75 1 0 34 76 1 0 34 77 1 0 34 78 1 0 35 79 1 0 35 80 1 0 35 81 1 0 36 82 1 0 36 83 1 0 37 84 1 0 37 85 1 0 M END