BEI7T1 -OEChem-04042105013D 44 45 0 1 0 0 0 0 0999 V2000 3.5302 1.7887 0.4652 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4236 1.9315 1.9056 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1619 2.8396 -0.3112 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6907 2.1424 -0.0236 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -2.5427 0.4747 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2327 0.6569 -1.2637 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6252 -0.9734 0.2708 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9744 1.4436 -0.1940 N 0 0 2 0 0 0 0 0 0 0 0 0 -1.2250 -0.0922 0.4614 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0474 0.6131 0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4243 0.2928 0.1498 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8909 1.1193 -1.6406 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1321 0.1412 -1.0426 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4216 -0.7334 1.0946 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3792 1.0034 0.3088 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8343 -2.0630 -0.3455 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8373 -1.0366 -1.2901 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1266 -1.9113 0.8471 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6262 -0.1347 0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5878 -3.3223 -0.6111 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3225 -1.3269 0.4663 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 1.0159 -0.1241 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7035 -1.3686 0.2745 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3883 -0.2179 -0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6921 0.9742 -0.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8297 -0.2394 -0.3227 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2302 -0.4472 0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1947 0.7898 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 0.0589 -1.8168 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8991 1.3605 -2.0331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 1.7204 -2.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1451 0.9258 -1.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -0.6385 2.0268 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3857 -1.1426 -2.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.7036 1.5909 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -0.9743 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6136 -3.2316 -0.2403 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -4.1786 -0.1211 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6203 -3.5446 -1.6832 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7876 -2.2235 0.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8429 1.9750 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1999 1.8897 -0.6087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -3.2268 0.7411 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2046 0.6358 -1.3955 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 4 15 2 0 0 0 0 5 23 1 0 0 0 0 5 43 1 0 0 0 0 6 26 1 0 0 0 0 6 44 1 0 0 0 0 7 26 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 15 1 0 0 0 0 9 19 1 0 0 0 0 9 36 1 0 0 0 0 10 15 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 17 1 0 0 0 0 13 32 1 0 0 0 0 14 18 2 0 0 0 0 14 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$