RDKit 3D 49 49 0 0 0 0 0 0 0 0999 V2000 4.9428 1.6483 -0.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2236 0.6795 -1.3548 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9464 -0.7474 -1.0731 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5564 -1.1426 -0.7616 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9057 -0.5296 0.4217 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4929 -1.1501 0.5085 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8143 -0.8554 -0.6459 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8022 -0.5911 1.7089 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -1.1457 1.8551 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.8143 0.8311 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7034 0.5300 0.8171 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0875 0.6677 1.1602 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8196 -0.2004 0.3565 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2580 -0.1068 0.7574 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7539 1.1862 0.5991 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 0.0881 -1.1122 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2022 -0.9983 -1.8183 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2238 0.2091 -1.5313 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1540 0.7380 -2.8057 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5989 1.1805 -0.5360 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4543 2.3086 -0.5612 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9136 1.1927 0.7566 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0628 2.2701 -0.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7805 2.4171 -0.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7098 0.9691 -2.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3181 0.8005 -1.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6927 -1.1591 -0.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2313 -1.3169 -2.0143 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5752 -2.2577 -0.5712 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9433 -1.0536 -1.6956 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6905 0.5586 0.3393 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4507 -0.7443 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6623 -2.2577 0.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4641 -1.6479 -1.1028 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7472 0.5089 1.7064 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -0.8222 2.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -2.2679 1.9858 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.8083 2.8239 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1506 1.0304 1.6188 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -1.2506 0.5325 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8902 -0.8457 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3949 -0.4037 1.8314 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5105 1.6838 1.4259 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 1.0119 -1.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5401 -0.6228 -2.6909 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8053 -0.8046 -1.4621 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9882 1.2140 -3.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5826 1.4816 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2641 2.1699 -0.0291 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 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 13 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 11 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 1 7 34 1 0 8 35 1 0 8 36 1 0 9 37 1 0 9 38 1 0 11 39 1 1 13 40 1 6 14 41 1 0 14 42 1 0 15 43 1 0 16 44 1 1 17 45 1 0 18 46 1 6 19 47 1 0 20 48 1 6 21 49 1 0 M END