B12AYW
-OEChem-04042103523D
49 53 0 0 0 0 0 0 0999 V2000
4.9211 -1.0978 0.5546 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5694 -3.3560 -0.2115 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8016 -3.5091 -0.7943 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1214 2.5419 1.0247 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4019 0.9867 0.6999 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0638 4.1756 -0.8539 N 0 0 0 0 0 0 0 0 0 0 0 0
-7.6018 0.5826 -0.1538 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0586 -0.3029 0.3182 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9863 -1.2014 -0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2740 -0.9218 0.2509 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6100 1.9484 1.1141 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1128 -2.2451 -0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4027 -0.8715 -0.0999 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3077 -2.4707 -0.4083 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7822 0.4251 0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7494 1.4148 0.7007 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3497 2.5671 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5599 -0.4699 0.5243 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1471 -3.1494 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4012 3.6113 0.3157 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6024 -1.3674 0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4032 -2.6628 -0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3949 -1.7790 -0.4906 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1321 0.8027 0.2653 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7393 -1.4002 -0.5033 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1072 -0.1121 -0.1264 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5245 -2.3604 0.2069 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3343 4.7978 -0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1976 5.1521 -1.5165 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4838 0.2713 -0.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2746 1.4896 1.8513 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1252 2.7637 1.6658 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5879 3.0347 -0.7073 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8099 1.8019 -0.7037 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8006 0.5181 0.8826 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9816 -4.1615 -0.7284 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1386 3.0951 0.9448 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9548 4.3932 0.9439 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1509 -2.7929 -0.7918 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4287 1.8074 0.5586 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4886 -2.1259 -0.8115 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2384 -2.1950 -0.6082 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0687 -2.7408 1.0789 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0116 4.0575 -0.0363 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8443 5.1988 -1.3597 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1968 5.6131 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9131 5.9750 -0.8504 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7077 5.5833 -2.3859 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2862 4.6889 -1.9059 H 0 0 0 0 0 0 0 0 0 0 0 0
1 21 1 0 0 0 0
1 27 1 0 0 0 0
2 22 1 0 0 0 0
2 27 1 0 0 0 0
3 14 2 0 0 0 0
4 16 2 0 0 0 0
5 8 1 0 0 0 0
5 11 1 0 0 0 0
5 16 1 0 0 0 0
6 20 1 0 0 0 0
6 28 1 0 0 0 0
6 29 1 0 0 0 0
7 30 3 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
9 13 1 0 0 0 0
9 14 1 0 0 0 0
10 12 1 0 0 0 0
10 18 2 0 0 0 0
11 17 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 14 1 0 0 0 0
12 19 2 0 0 0 0
13 15 2 0 0 0 0
13 23 1 0 0 0 0
15 16 1 0 0 0 0
15 24 1 0 0 0 0
17 20 1 0 0 0 0
17 33 1 0 0 0 0
17 34 1 0 0 0 0
18 21 1 0 0 0 0
18 35 1 0 0 0 0
19 22 1 0 0 0 0
19 36 1 0 0 0 0
20 37 1 0 0 0 0
20 38 1 0 0 0 0
21 22 2 0 0 0 0
23 25 2 0 0 0 0
23 39 1 0 0 0 0
24 26 2 0 0 0 0
24 40 1 0 0 0 0
25 26 1 0 0 0 0
25 41 1 0 0 0 0
26 30 1 0 0 0 0
27 42 1 0 0 0 0
27 43 1 0 0 0 0
28 44 1 0 0 0 0
28 45 1 0 0 0 0
28 46 1 0 0 0 0
29 47 1 0 0 0 0
29 48 1 0 0 0 0
29 49 1 0 0 0 0
M END
$$$$