BC1I2F
-OEChem-04022117213D
42 44 0 1 0 0 0 0 0999 V2000
-6.0437 1.0374 -1.2474 F 0 0 0 0 0 0 0 0 0 0 0 0
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4.0670 0.9213 -0.2036 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2220 1.5340 0.9785 N 0 0 0 0 0 0 0 0 0 0 0 0
4.3240 1.6627 -1.2901 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6745 2.8489 -0.8085 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6132 -0.5473 -0.3082 C 0 0 1 0 0 0 0 0 0 0 0 0
4.2499 -1.4615 0.8133 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1323 -0.6481 -0.4523 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9350 -2.9441 0.5559 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7766 -1.3089 0.9102 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3008 -0.2286 0.5863 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5807 -1.1619 -1.6223 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0956 -0.3182 0.4671 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.1956 -1.2581 -1.7579 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9477 0.0994 1.5024 C 0 0 0 0 0 0 0 0 0 0 0 0
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-2.8845 -0.5108 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3329 0.0031 1.3668 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6035 2.7393 0.5483 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0238 0.3617 0.7604 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3045 0.5913 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0883 -0.8461 -1.2554 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8250 -1.1890 1.7878 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8576 -3.1338 0.5871 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3964 -3.5784 1.3206 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3106 -3.2645 -0.4218 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1892 -2.0069 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0726 -0.3052 1.2248 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2535 -1.5170 -0.0537 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7340 0.1682 1.5024 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2147 -1.4943 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2136 -1.6632 -2.6811 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5379 0.4986 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5004 -1.3296 -1.7504 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9433 0.3145 2.2093 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8311 3.5426 1.2316 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2501 -0.0128 1.7646 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5097 1.3279 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0
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10 12 1 0 0 0 0
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11 14 2 0 0 0 0
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13 31 1 0 0 0 0
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15 18 2 0 0 0 0
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24 41 1 0 0 0 0
24 42 1 0 0 0 0
M END
$$$$