RDKit 3D 95 97 0 0 0 0 0 0 0 0999 V2000 7.2799 1.2854 4.4346 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2179 2.0148 3.9657 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0814 1.9876 2.6186 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 0.6801 2.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5929 -0.3208 2.7432 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 0.5409 0.5738 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3392 -0.7270 -0.0660 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9239 -0.7337 -0.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0925 -0.3495 0.4155 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3592 -1.0862 -1.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2329 -1.3782 -2.8438 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -2.1061 -3.8908 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5941 -3.0914 -3.5332 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8359 -2.7579 -2.3047 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9924 -1.2190 -2.1049 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9096 -0.7269 -1.3102 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8718 -0.7196 -0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2463 -0.1894 -1.9531 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4014 0.3207 -1.1185 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3937 1.8121 -1.5375 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3623 2.6860 -0.9385 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6418 2.8418 -1.4327 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 3.7150 -0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1645 4.4651 0.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 4.3249 0.7585 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0097 3.4494 0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6052 -0.3896 -1.6226 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0583 -1.7968 -1.7755 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7427 -0.6920 -0.7328 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8544 -1.3091 -1.5795 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1507 0.0854 0.3912 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4085 0.7706 1.1098 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5375 0.0944 0.7615 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9997 0.8680 1.9022 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1094 1.8245 1.4932 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3653 0.9762 1.5778 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1101 0.0973 2.6804 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1221 -0.5742 3.4375 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5420 -0.3989 3.1264 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7893 -1.3311 4.3903 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7052 0.0158 2.8864 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1602 -0.6769 3.7713 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3045 -1.2817 -0.9997 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8260 -2.5502 -1.4238 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6558 -1.6118 -0.3714 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3453 -0.4305 0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5001 -2.7549 0.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2585 1.6615 3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4141 1.4556 5.5444 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1368 0.2202 4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3932 2.7901 2.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0913 2.2954 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8054 1.4027 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3381 -1.4522 0.8391 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5467 -0.3968 -3.1309 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2226 -1.4051 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4866 -2.6440 -4.4337 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1017 -4.0757 -3.3692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8855 -3.2804 -4.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1251 -3.2784 -1.3906 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7505 -2.9061 -2.4616 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8653 -0.8368 -3.1676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3703 -0.1130 -2.9606 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1232 0.2322 -0.1098 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4445 1.8663 -2.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3261 2.1521 -1.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9969 2.2818 -2.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5283 3.8463 -1.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8103 5.1644 0.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5847 4.9144 1.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0065 3.3687 0.6052 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8206 -0.1391 -2.6504 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8488 -2.2568 -2.0937 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4023 -1.7211 -0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5185 -1.4014 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7316 -0.5902 -1.6328 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -2.2927 -1.2557 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2814 -0.4370 0.2617 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 1.4369 2.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2257 2.6369 2.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9878 2.1804 0.4636 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4588 0.3368 0.6594 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2722 1.5685 1.6751 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1732 -0.3900 4.0614 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9632 -1.2254 2.4986 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7797 0.5411 2.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5428 -0.7240 -1.9122 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4706 -2.8734 -2.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2892 -2.0029 -1.1912 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4613 -0.4526 0.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3063 -0.4498 1.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0258 0.5521 -0.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7456 -2.4387 1.6715 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4578 -3.1702 0.5924 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1731 -3.6031 0.3939 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 19 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 2 0 37 41 1 0 41 42 2 0 7 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 45 47 1 0 15 10 1 0 26 21 1 0 41 34 1 0 1 48 1 0 1 49 1 0 1 50 1 0 3 51 1 0 3 52 1 0 6 53 1 0 7 54 1 1 11 55 1 0 12 56 1 0 12 57 1 0 13 58 1 0 13 59 1 0 14 60 1 0 14 61 1 0 15 62 1 6 18 63 1 0 19 64 1 1 20 65 1 0 20 66 1 0 22 67 1 0 23 68 1 0 24 69 1 0 25 70 1 0 26 71 1 0 27 72 1 6 28 73 1 0 29 74 1 1 30 75 1 0 30 76 1 0 30 77 1 0 33 78 1 0 34 79 1 1 35 80 1 0 35 81 1 0 36 82 1 0 36 83 1 0 39 84 1 0 39 85 1 0 39 86 1 0 43 87 1 6 44 88 1 0 45 89 1 6 46 90 1 0 46 91 1 0 46 92 1 0 47 93 1 0 47 94 1 0 47 95 1 0 M END