RDKit 3D 101105 0 0 0 0 0 0 0 0999 V2000 -2.4071 -0.5214 5.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3288 -1.4116 4.8909 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7091 -0.7139 3.8555 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0674 -1.5860 3.0632 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6938 -0.7948 2.1401 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4314 -1.1512 0.8196 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6352 -1.5439 0.0549 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3830 -2.5439 -0.8824 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3418 -0.4057 -0.6319 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6377 -0.2130 -0.1759 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 -0.3640 -1.1491 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6568 -1.7524 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7187 -1.8423 -2.7493 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0091 -2.1937 -2.4948 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9593 -2.2733 -3.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5854 -1.9844 -4.7992 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5278 -2.0559 -5.8382 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2873 -1.6278 -5.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8783 -1.3300 -6.3884 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3702 -1.5570 -4.0743 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6664 0.7995 -0.4786 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3455 0.6018 -0.8928 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2157 1.7470 -1.6305 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2741 2.9748 -1.1499 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9876 3.3673 -0.1027 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9119 4.3840 -0.3493 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4392 5.5823 -0.7305 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5056 6.6333 -0.3726 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 6.3690 -1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1644 6.0793 -0.1360 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5703 6.7036 -1.1406 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 4.9945 0.4400 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5371 5.4954 1.4332 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1338 3.8879 1.0455 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7156 2.9644 1.5869 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4052 -0.0337 0.2019 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6525 -0.5810 -0.2128 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8713 -0.3356 0.3241 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9761 0.4478 1.2956 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1158 -0.9504 -0.1787 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9971 -1.7693 -1.2017 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0799 -2.4741 -1.8465 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8335 -3.3016 -2.9449 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8537 -3.9743 -3.5753 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1488 -3.8528 -3.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2223 -4.5199 -3.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4171 -3.0448 -2.0661 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7141 -2.8950 -1.5988 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3795 -2.3639 -1.4284 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -2.2051 3.9761 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9976 -3.5788 4.0332 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -1.6600 5.3891 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4957 -0.3365 5.4322 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3426 -1.7124 5.9881 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3886 -0.7021 6.9716 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8708 -1.0897 6.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2103 -0.3077 4.7174 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9825 0.3908 5.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.3196 4.4598 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5418 -2.3952 2.6428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2438 -2.0276 0.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3739 -1.9846 0.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3972 -2.5420 -1.0381 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3942 -0.6077 -1.7186 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5894 -0.1669 -0.6654 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5025 0.4044 -1.9646 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8584 -2.4562 -0.8793 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7077 -2.0201 -2.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2914 -2.4190 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9731 -2.5459 -3.3116 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4693 -2.3203 -5.6024 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 -1.3834 -7.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3615 -1.2781 -4.2991 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4973 -0.2010 -1.7425 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2395 1.4324 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3952 1.8052 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5848 2.5489 0.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4089 5.6032 -1.8573 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6011 6.6309 0.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1614 7.6551 -0.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4435 6.7990 -0.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3287 6.8300 0.6628 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6642 7.6656 -0.9601 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3184 4.5378 -0.3514 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0086 5.5592 2.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 4.2843 1.8151 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4631 2.7664 2.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6168 0.6704 1.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0807 -0.7673 0.2376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9848 -1.9484 -1.6186 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8035 -3.4134 -3.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6408 -4.6045 -4.4186 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9719 -5.1115 -4.5563 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4501 -3.3831 -2.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6083 -1.7408 -0.5892 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 -1.9749 3.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8929 -3.9402 4.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -2.2873 6.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7283 0.3058 5.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5845 -2.6878 6.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1454 -0.8399 7.5959 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 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 2 0 9 21 1 0 21 22 1 0 22 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 1 0 27 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 22 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 2 0 41 42 1 0 42 49 2 0 49 47 1 0 47 48 1 0 47 45 2 0 45 46 1 0 45 44 1 0 44 43 2 0 4 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 54 2 1 0 36 6 1 0 43 42 1 0 20 13 1 0 34 25 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 6 4 60 1 6 6 61 1 1 7 62 1 1 8 63 1 0 9 64 1 6 11 65 1 0 11 66 1 0 12 67 1 0 12 68 1 0 14 69 1 0 15 70 1 0 17 71 1 0 19 72 1 0 20 73 1 0 22 74 1 6 23 75 1 0 23 76 1 0 25 77 1 1 27 78 1 6 28 79 1 0 28 80 1 0 29 81 1 0 30 82 1 1 31 83 1 0 32 84 1 6 33 85 1 0 34 86 1 1 35 87 1 0 36 88 1 1 40 89 1 0 41 90 1 0 49 95 1 0 48 94 1 0 46 93 1 0 44 92 1 0 43 91 1 0 50 96 1 6 51 97 1 0 52 98 1 1 53 99 1 0 54100 1 1 55101 1 0 M END