RDKit 3D 29 31 0 0 0 0 0 0 0 0999 V2000 4.6987 0.8451 0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8752 0.5599 -1.0154 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4132 -0.5577 -1.6809 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4311 0.3181 -0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8677 -0.8191 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5062 -0.6365 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2878 0.6451 -0.4551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4471 1.1649 -0.8498 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0788 1.1523 -0.4269 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3204 2.3009 -0.8352 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1771 0.3339 0.0743 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 0.8245 0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6661 2.1280 -0.3796 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5317 0.0585 0.5714 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3225 -1.2228 1.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0316 -1.7022 1.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9745 -0.9506 0.5421 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6029 -1.4439 0.5077 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3907 -2.6083 0.9271 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7657 0.7405 -0.0858 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4943 1.8736 0.5804 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5098 0.0755 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9799 1.4027 -1.7259 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0076 -1.3698 -1.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3956 -1.7197 0.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5503 2.5909 -0.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5128 0.5065 0.5589 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1763 -1.7771 1.3945 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8571 -2.7132 1.3761 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 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 8 4 1 0 17 11 1 0 18 6 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 6 3 24 1 0 5 25 1 0 13 26 1 0 14 27 1 0 15 28 1 0 16 29 1 0 M END