RDKit 3D 175181 0 0 0 0 0 0 0 0999 V2000 0.5347 -6.1400 4.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9621 -4.9696 3.2009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3871 -3.7531 3.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4961 -3.6091 4.4208 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0229 -2.4228 4.6387 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9587 -2.3685 5.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2868 -3.6233 6.4401 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5419 -1.1714 5.9606 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -0.0369 5.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2929 -0.1371 4.2095 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2768 1.0063 3.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4101 1.8589 3.3215 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3013 1.0052 2.2897 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6525 1.8527 1.1930 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8961 2.5838 1.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8463 3.1733 2.6667 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0605 2.7037 0.7273 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 3.2819 -0.5354 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0801 4.6318 -0.3580 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3078 5.1842 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1707 5.5468 0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9228 2.5094 -1.6157 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0066 2.3055 -2.5818 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1716 1.9598 -1.8762 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7644 1.8673 -3.2572 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.9600 2.7481 -3.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2736 0.4240 -3.2811 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2987 -0.0419 -1.8309 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2127 1.3368 -1.1474 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.2292 1.2494 0.2866 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7537 2.2510 0.9119 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7317 0.1763 1.0983 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5248 -0.2804 2.2012 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4435 -0.4606 0.8551 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4848 -1.9104 0.6916 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2498 -2.6002 1.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7034 -2.6818 -0.2609 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4031 -3.8017 -0.9034 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3279 -2.4341 -0.5650 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9205 -2.1700 -1.9587 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1783 -3.3316 -2.8986 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6587 -0.9923 -2.6146 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6652 -1.5478 0.4564 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -2.2439 1.5039 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4222 -0.2847 0.4285 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8991 0.8724 0.0029 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4523 0.5894 -0.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6667 -1.3147 3.8931 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2672 -1.3846 2.8931 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8235 -2.5871 2.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7629 -2.7309 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4034 -1.6503 0.9707 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3849 -2.0060 0.1797 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1568 -0.2846 1.0115 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0655 0.6333 0.1995 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7503 1.4547 1.2004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0263 2.4877 1.5396 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 1.3591 1.8476 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3604 1.4583 1.4298 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7261 2.8035 0.9064 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5251 3.8279 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9546 3.2379 -0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8673 0.2737 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9834 -0.4265 0.1618 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1786 -0.2929 0.6841 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5173 -1.6828 0.9604 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7155 -2.7215 0.2966 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9710 -1.7716 0.6339 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6158 -2.6959 0.2082 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4915 -0.4161 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3693 0.4108 0.2885 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6135 0.5110 -1.1598 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7116 -0.0954 -1.5345 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9162 1.1179 -2.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6506 2.2315 -2.8966 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6102 0.8831 -2.7454 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1568 -0.5347 -2.7514 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9799 -1.4285 -2.6133 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7521 -0.8406 -2.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -2.2612 -2.9435 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 0.1245 -3.0793 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7315 0.5083 -4.5663 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3758 -0.2804 -2.6583 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -1.5362 -2.8404 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3824 0.4500 -2.1062 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3462 1.2523 -0.9282 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5612 2.6953 -1.2426 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2889 -4.0331 1.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2382 -4.2363 0.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8936 -5.1109 2.2077 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3602 -6.2730 2.0231 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0011 -6.8279 3.3018 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1076 -5.8408 4.8524 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -6.7017 4.3945 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5582 -4.4218 6.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1786 -3.4076 7.5084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3348 -3.9259 6.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2661 -1.1097 6.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 0.8580 5.4958 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0076 0.1809 2.4128 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8251 2.5102 0.9275 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9249 2.3081 1.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3026 3.6955 -0.8812 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0532 4.4594 0.0955 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3415 5.1923 -2.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0031 4.5716 -2.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7639 6.1987 -1.7232 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9882 6.4539 -0.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6113 5.8827 1.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1899 5.0972 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0373 1.9363 -4.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1064 3.4291 -2.5013 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9314 2.1688 -3.4416 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9326 3.3827 -4.2724 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6619 -0.2248 -3.9266 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3103 0.3975 -3.7143 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2579 -0.5445 -1.6444 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4103 -0.6468 -1.6954 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2396 1.7612 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4177 -0.8700 1.8962 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9545 -0.7388 3.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9818 0.6529 2.6643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9195 0.0731 0.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8005 -0.2696 1.7705 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7696 -4.6299 -1.1913 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1012 -4.2178 -0.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0646 -3.4835 -1.7168 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8131 -3.4731 -0.3527 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -1.9895 -1.9941 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -3.1697 -3.8611 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2382 -3.3987 -3.1366 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8318 -4.2623 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7988 -0.2206 -1.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5683 -1.3188 -3.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9405 -0.5400 -3.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3991 1.4913 -0.7302 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9161 0.1958 0.4118 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0535 1.6159 -0.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4167 -0.0547 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4172 0.1799 1.5409 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -0.1549 -0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8885 1.1626 2.9256 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9553 1.4667 2.4479 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7796 2.8457 0.6405 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4873 3.9186 2.5625 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3375 4.8464 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6568 3.5985 2.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3264 2.4091 -0.6916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3089 4.0954 -0.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 3.5649 -1.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4933 -1.9054 2.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8478 -2.3820 -0.2794 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2881 -3.4760 1.0305 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3211 -3.3113 -0.4791 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4696 -0.2224 0.4857 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4277 -0.2346 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4758 1.3848 0.8347 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3088 2.2196 -3.9481 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 3.2086 -2.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7186 2.0733 -2.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6415 1.1977 -3.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8472 1.5119 -2.2961 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3752 -2.8730 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8049 -2.5542 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -2.6024 -2.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9232 1.0887 -2.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7364 0.3058 -4.9954 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0082 -0.1218 -5.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 1.5606 -4.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2416 1.1951 -0.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6026 3.2031 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1223 3.2581 -0.5032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2033 2.7134 -2.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9434 -4.4528 -0.5191 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2715 -4.1719 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 18 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 2 0 35 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 39 43 1 0 43 44 2 0 43 45 1 0 45 46 1 0 46 47 1 0 10 48 2 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 54 55 1 0 55 56 1 0 56 57 2 0 56 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 60 62 1 0 59 63 1 0 63 64 2 0 63 65 1 0 65 66 1 0 66 67 1 0 66 68 1 0 68 69 2 0 68 70 1 0 70 71 1 0 71 72 1 0 72 73 2 0 72 74 1 0 74 75 1 0 74 76 1 0 76 77 1 0 77 78 2 0 77 79 1 0 79 80 1 0 79 81 1 0 81 82 1 0 81 83 1 0 83 84 2 0 83 85 1 0 85 86 1 0 86 87 1 0 51 88 2 0 88 89 1 0 88 90 1 0 90 91 2 0 90 2 1 0 50 3 1 0 86 55 1 0 48 5 1 0 71 65 1 0 46 14 1 0 29 24 1 0 1 92 1 0 1 93 1 0 1 94 1 0 7 95 1 0 7 96 1 0 7 97 1 0 8 98 1 0 9 99 1 0 13100 1 0 14101 1 6 17102 1 0 18103 1 6 19104 1 1 20105 1 0 20106 1 0 20107 1 0 21108 1 0 21109 1 0 21110 1 0 25111 1 6 26112 1 0 26113 1 0 26114 1 0 27115 1 0 27116 1 0 28117 1 0 28118 1 0 29119 1 6 33120 1 0 33121 1 0 33122 1 0 34123 1 0 34124 1 0 38125 1 0 38126 1 0 38127 1 0 39128 1 1 40129 1 1 41130 1 0 41131 1 0 41132 1 0 42133 1 0 42134 1 0 42135 1 0 46136 1 6 47137 1 0 47138 1 0 47139 1 0 54140 1 0 55141 1 6 58142 1 0 59143 1 1 60144 1 6 61145 1 0 61146 1 0 61147 1 0 62148 1 0 62149 1 0 62150 1 0 66151 1 1 67152 1 0 67153 1 0 67154 1 0 70155 1 0 70156 1 0 71157 1 1 75158 1 0 75159 1 0 75160 1 0 76161 1 0 76162 1 0 80163 1 0 80164 1 0 80165 1 0 81166 1 1 82167 1 0 82168 1 0 82169 1 0 86170 1 1 87171 1 0 87172 1 0 87173 1 0 89174 1 0 89175 1 0 M END