RDKit 3D 41 45 0 0 0 0 0 0 0 0999 V2000 3.0860 1.0140 1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2769 0.7030 -0.2156 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3501 0.4827 -1.2987 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5814 -0.5407 -0.0237 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6550 -0.7094 1.1460 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3245 -2.1434 0.8943 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1262 -3.0146 1.7684 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2849 -2.3033 -0.4835 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7156 -1.0741 -1.1109 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5265 -0.3201 -1.3985 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4288 -1.2489 -1.9611 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1658 0.3912 -0.2448 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2067 1.9110 -0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 0.0759 1.0948 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4165 1.2557 1.8573 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6799 -0.6916 1.8277 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8664 -0.0776 2.1832 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7644 -0.8822 1.0077 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6261 -0.0052 -0.2063 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5009 -0.0234 -1.3331 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6303 0.9410 -0.3516 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 1.4242 0.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2046 0.1004 1.6749 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5581 1.7691 1.6656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7536 1.6009 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6783 1.4693 -1.6989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 -0.0021 -0.8658 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8799 -0.0744 -2.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3714 -1.3452 0.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1755 -0.5553 2.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2368 -1.3214 -2.0322 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3222 0.4017 -2.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1926 -1.5091 -2.8632 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1639 2.0568 -1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1624 2.3249 -0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 2.4298 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3689 1.1676 2.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3628 -1.4486 2.6044 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4841 -1.7005 0.8942 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1396 0.2863 -2.3352 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2964 -0.8145 -1.4181 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 4 9 1 0 9 8 1 0 8 6 1 0 6 7 2 0 6 5 1 0 5 14 1 0 14 15 1 1 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 19 12 1 0 12 13 1 6 12 10 1 0 10 11 1 0 5 4 1 0 12 14 1 0 10 9 1 0 18 16 1 0 19 21 1 1 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 3 26 1 0 3 27 1 0 3 28 1 0 4 29 1 1 9 31 1 6 5 30 1 1 15 37 1 0 16 38 1 1 18 39 1 6 20 40 1 0 20 41 1 0 13 34 1 0 13 35 1 0 13 36 1 0 10 32 1 6 11 33 1 0 M END