B5WS8T -OEChem-04042104203D 44 45 0 0 0 0 0 0 0999 V2000 -5.2950 0.7375 -0.4364 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6422 -0.0496 -1.3088 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9277 -0.7284 1.6361 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0295 -0.3983 0.0984 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 2.0914 -0.0824 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4115 -2.2677 1.2336 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9238 -2.5050 -0.8936 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 0.3559 -0.4996 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3865 1.2170 0.4559 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8327 -1.8825 0.1906 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3733 -0.8402 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3781 -1.4474 -1.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6489 -0.0553 1.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4361 -0.3841 -1.5809 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7001 0.9818 0.4602 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3913 0.4547 -0.4682 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7949 1.2314 0.6784 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8955 0.3367 0.6164 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5454 0.2226 0.9592 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6011 0.5529 -0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0456 -0.6985 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6928 -0.8066 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4511 1.5880 0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8038 1.6961 0.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3343 0.5973 -2.2076 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9804 -1.6327 0.4163 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0599 -0.1733 -0.5707 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9165 -1.9363 -1.8416 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7915 -2.2208 -0.5111 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 -0.7533 1.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3795 0.4387 1.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6957 -0.8544 -2.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9926 0.3428 -2.1843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1658 1.4891 1.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2657 1.7464 -0.0856 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1326 2.2705 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0366 0.7534 1.6315 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0155 1.9334 -0.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2624 -1.7851 0.7638 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8719 2.5046 0.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2104 2.6823 -0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3707 0.7117 -2.5326 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 1.3903 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9605 -0.3846 -2.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 20 1 0 0 0 0 1 25 1 0 0 0 0 2 16 2 0 0 0 0 3 19 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 9 38 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$