B8SG7L
-OEChem-04042106033D
49 52 0 1 0 0 0 0 0999 V2000
5.6347 1.4553 -0.5090 F 0 0 0 0 0 0 0 0 0 0 0 0
5.6848 0.5394 1.4562 F 0 0 0 0 0 0 0 0 0 0 0 0
7.0880 -0.1029 -0.0756 F 0 0 0 0 0 0 0 0 0 0 0 0
-2.7695 2.4603 -1.1461 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2197 -2.5001 2.0202 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1300 -2.0845 1.2285 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0754 1.6926 0.2000 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0891 0.5047 0.0855 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.3863 0.6106 -1.5451 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.9847 -0.5028 -1.0432 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1878 2.3458 0.3825 C 0 0 1 0 0 0 0 0 0 0 0 0
0.8639 1.4181 1.5558 C 0 0 2 0 0 0 0 0 0 0 0 0
1.9881 1.4562 -0.5672 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0354 0.4386 1.6548 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8870 0.6597 0.3871 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1682 2.7792 -0.1438 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4603 0.7654 1.1494 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4501 -0.6043 -0.2162 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3612 1.6125 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8271 -0.7900 -0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5713 -1.5947 -0.6551 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3255 -1.9659 -0.8984 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7873 0.2560 0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0696 -2.7707 -1.2158 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4467 -2.9564 -1.3375 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4076 0.1338 -0.2758 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0164 -0.9992 0.2346 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1270 0.9103 -1.1619 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3044 -1.2807 -0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3477 -1.8864 1.1745 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7976 3.2028 0.6908 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7282 1.9860 2.4835 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5746 2.0481 -1.2786 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3268 0.8111 -1.1572 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6889 -0.5925 1.7831 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6442 0.6679 2.5384 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6822 1.3489 0.6858 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5263 3.6739 0.3779 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1812 2.9737 -1.2206 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1156 0.6209 2.0143 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3305 -0.1970 0.6431 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4953 -1.4750 -0.5675 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6328 -0.1256 0.7354 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3939 -2.1329 -1.0035 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3855 -3.5423 -1.5568 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8344 -3.8723 -1.7739 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7760 1.8147 -1.6326 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8536 -2.1521 0.1647 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7597 -3.0956 2.6496 H 0 0 0 0 0 0 0 0 0 0 0 0
1 23 1 0 0 0 0
2 23 1 0 0 0 0
3 23 1 0 0 0 0
4 19 2 0 0 0 0
5 30 1 0 0 0 0
5 49 1 0 0 0 0
6 30 2 0 0 0 0
7 16 1 0 0 0 0
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7 19 1 0 0 0 0
8 19 1 0 0 0 0
8 26 1 0 0 0 0
8 43 1 0 0 0 0
9 10 2 0 0 0 0
9 28 1 0 0 0 0
10 29 1 0 0 0 0
11 12 1 0 0 0 0
11 13 1 0 0 0 0
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12 14 1 0 0 0 0
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13 15 1 0 0 0 0
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14 15 1 0 0 0 0
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14 36 1 0 0 0 0
15 18 1 0 0 0 0
15 37 1 0 0 0 0
16 38 1 0 0 0 0
16 39 1 0 0 0 0
17 40 1 0 0 0 0
17 41 1 0 0 0 0
18 20 1 0 0 0 0
18 21 2 0 0 0 0
20 22 2 0 0 0 0
20 23 1 0 0 0 0
21 24 1 0 0 0 0
21 42 1 0 0 0 0
22 25 1 0 0 0 0
22 44 1 0 0 0 0
24 25 2 0 0 0 0
24 45 1 0 0 0 0
25 46 1 0 0 0 0
26 27 1 0 0 0 0
26 28 2 0 0 0 0
27 29 2 0 0 0 0
27 30 1 0 0 0 0
28 47 1 0 0 0 0
29 48 1 0 0 0 0
M END
$$$$