BK6AR1
-OEChem-04022107373D
54 58 0 1 0 0 0 0 0999 V2000
0.0180 0.8591 0.2084 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0979 1.2005 0.2492 N 0 3 0 0 0 0 0 0 0 0 0 0
-3.5503 0.0467 1.1149 C 0 0 1 0 0 0 0 0 0 0 0 0
-3.5172 0.8022 -1.1237 C 0 0 2 0 0 0 0 0 0 0 0 0
-3.8444 -1.1935 0.2546 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8232 -0.7029 -1.1989 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0328 0.2197 1.3051 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9967 1.0414 -1.1299 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2600 0.2751 -0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5443 2.5615 0.7164 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6167 1.3608 0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0114 0.2988 -0.6536 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0478 -1.2025 -0.4647 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3592 0.9649 -0.4562 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4606 -1.7980 0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0735 0.8695 0.7549 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6372 -2.0276 -1.5275 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9019 1.7182 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8896 -1.0247 1.9202 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5837 0.1236 1.9247 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4249 -3.1977 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2953 1.5515 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6237 -3.4155 -1.3954 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1235 2.3750 -1.3725 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0144 -4.0003 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8187 2.2943 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0803 0.0418 2.0729 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0216 1.3836 -1.9025 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8393 -1.5889 0.4915 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1332 -2.0083 0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0999 -1.2531 -1.8099 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8078 -0.8652 -1.6533 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7995 1.0808 1.9416 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6500 -0.6322 1.8847 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7529 2.1096 -1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6017 0.7088 -2.0997 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2090 -0.7648 -0.3438 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9370 2.7497 1.7211 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4581 2.6073 0.7472 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9129 3.3233 0.0217 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9179 1.5918 1.3063 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8924 2.1684 -0.4035 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0792 0.4254 -0.0417 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6956 0.5139 -1.6831 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3167 -1.5914 -2.4709 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3706 1.8048 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6350 -1.4631 2.8834 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8506 0.5467 2.8915 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7254 -3.6798 1.7954 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8586 1.5045 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3021 -4.0371 -2.2256 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5275 2.9535 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9991 -5.0807 -0.0878 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7676 2.8097 -0.0565 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 12 1 0 0 0 0
2 3 1 0 0 0 0
2 4 1 0 0 0 0
2 10 1 0 0 0 0
2 11 1 0 0 0 0
3 5 1 0 0 0 0
3 7 1 0 0 0 0
3 27 1 0 0 0 0
4 6 1 0 0 0 0
4 8 1 0 0 0 0
4 28 1 0 0 0 0
5 6 1 0 0 0 0
5 29 1 0 0 0 0
5 30 1 0 0 0 0
6 31 1 0 0 0 0
6 32 1 0 0 0 0
7 9 1 0 0 0 0
7 33 1 0 0 0 0
7 34 1 0 0 0 0
8 9 1 0 0 0 0
8 35 1 0 0 0 0
8 36 1 0 0 0 0
9 37 1 0 0 0 0
10 38 1 0 0 0 0
10 39 1 0 0 0 0
10 40 1 0 0 0 0
11 41 1 0 0 0 0
11 42 1 0 0 0 0
11 43 1 0 0 0 0
12 13 1 0 0 0 0
12 14 1 0 0 0 0
12 44 1 0 0 0 0
13 15 1 0 0 0 0
13 17 2 0 0 0 0
14 16 1 0 0 0 0
14 18 2 0 0 0 0
15 19 1 0 0 0 0
15 21 2 0 0 0 0
16 20 1 0 0 0 0
16 22 2 0 0 0 0
17 23 1 0 0 0 0
17 45 1 0 0 0 0
18 24 1 0 0 0 0
18 46 1 0 0 0 0
19 20 2 0 0 0 0
19 47 1 0 0 0 0
20 48 1 0 0 0 0
21 25 1 0 0 0 0
21 49 1 0 0 0 0
22 26 1 0 0 0 0
22 50 1 0 0 0 0
23 25 2 0 0 0 0
23 51 1 0 0 0 0
24 26 2 0 0 0 0
24 52 1 0 0 0 0
25 53 1 0 0 0 0
26 54 1 0 0 0 0
M CHG 1 2 1
M END
$$$$