BA9RN4 -OEChem-04022114153D 39 40 0 1 0 0 0 0 0999 V2000 -2.9394 -1.8588 0.2499 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8979 0.4422 0.2502 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8078 1.9544 -0.9091 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9378 -0.7644 -0.1219 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5695 -0.5383 -2.2148 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8327 0.9024 -0.2263 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0921 0.8707 -0.2214 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0146 0.1372 -1.0491 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1358 0.3295 -0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.7187 0.6301 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3073 -0.9251 -0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2545 0.0096 -0.2535 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2665 -1.1664 0.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4303 1.6309 0.9498 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2201 -0.0500 0.2666 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4208 0.7090 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -1.6683 1.0293 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4079 2.4634 1.7683 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6157 0.2101 0.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6278 -0.9694 0.7779 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5561 1.6183 -0.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3364 0.9011 -1.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2237 0.3109 -1.7841 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 1.2836 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4602 -1.7441 1.6678 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2085 -2.7071 0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6596 2.3017 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9242 0.9319 1.6262 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5833 -0.7128 -0.5245 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0806 0.5449 0.5923 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9132 -0.6616 1.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3754 1.6170 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4558 -2.5789 1.6183 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0893 0.1284 -2.7842 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8142 -0.8872 -2.8039 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1148 1.8325 2.3151 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8633 3.0620 2.5058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9733 3.1479 1.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5493 -1.3716 1.1926 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 6 1 0 0 0 0 3 6 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 21 1 0 0 0 0 8 11 1 0 0 0 0 8 22 1 0 0 0 0 9 12 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 19 2 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 M CHG 2 2 -1 6 1 M END $$$$