RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 4.9009 2.7416 1.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5989 2.3492 0.8525 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5378 0.9480 0.6959 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1672 0.6025 -0.7041 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 0.9162 -1.7996 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 0.1862 -1.4785 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0198 0.0362 -1.0579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0298 -0.2798 0.0039 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0076 -1.1730 -0.4206 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2006 -2.4050 -0.9367 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7238 -3.2349 -1.2241 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0192 -2.9783 -1.2336 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9681 -2.0671 -0.8867 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3489 -2.1365 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9202 -3.1532 -1.4335 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0673 -1.0438 -0.5418 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4484 -1.0343 -0.5976 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 -2.1295 -1.0924 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1597 0.0504 -0.1666 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9089 0.0743 -0.2320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.4841 1.1459 0.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 1.1428 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3869 2.3192 0.9193 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3829 0.0459 -0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0718 0.0631 0.0157 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.9571 -0.3864 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8392 -0.8062 1.1734 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0500 -1.3696 2.1544 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5885 0.3905 1.7204 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2760 0.0402 2.8735 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9177 3.8300 1.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6255 2.4203 0.4259 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1835 2.2670 2.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5626 0.5465 0.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4218 1.9774 -1.7717 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7866 0.5728 -2.7642 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0286 -0.7055 -1.1626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8008 -0.1944 -2.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5713 0.6748 0.3539 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2049 -3.9608 -1.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1171 -2.1459 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0282 2.0199 0.6776 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 2.1227 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5283 2.5412 0.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0299 3.2052 0.9295 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 -1.5043 0.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1042 -2.3593 2.1613 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8386 1.1893 1.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8047 -0.7810 2.7105 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 4 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 2 0 21 22 1 0 22 23 1 0 22 24 2 0 24 25 1 0 25 26 1 0 8 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 3 1 0 26 9 1 0 26 13 2 0 24 16 1 0 1 31 1 0 1 32 1 0 1 33 1 0 3 34 1 1 5 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 8 39 1 1 12 40 1 0 18 41 1 0 21 42 1 0 23 43 1 0 23 44 1 0 23 45 1 0 27 46 1 6 28 47 1 0 29 48 1 1 30 49 1 0 M END