B2PT7E
-OEChem-04022117313D
48 51 0 1 0 0 0 0 0999 V2000
3.1859 1.7854 -1.9445 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.8714 2.6507 -1.6429 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3442 -1.9118 0.3194 N 0 0 2 0 0 0 0 0 0 0 0 0
-0.9925 0.6314 -0.7543 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6452 -4.2405 -1.5005 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.2094 1.0356 -0.5364 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.7999 -1.0385 0.6652 N 0 0 0 0 0 0 0 0 0 0 0 0
2.2036 -2.9865 -0.8930 C 0 0 1 0 0 0 0 0 0 0 0 0
0.7597 -3.1278 -0.3927 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1480 -2.5993 0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2210 -1.4622 1.4097 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6589 -1.3195 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0182 -1.6050 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5750 -0.4478 -0.0759 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9365 -0.2079 0.0626 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8801 -2.4971 1.0564 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0050 1.5844 -1.0577 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4012 0.7628 -1.0925 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2378 -2.1741 1.1507 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5249 1.6186 -0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1152 1.7118 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3763 2.2208 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4860 2.0825 1.0145 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0083 3.1006 0.3953 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1180 2.9621 1.8934 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3792 3.4713 1.5838 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2392 -2.2024 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0981 -3.3036 -1.2512 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6651 -3.9922 0.2777 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2013 -3.4040 0.9918 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1653 -2.4456 -0.1334 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8833 -0.5109 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1809 -2.1958 2.2252 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7479 -0.5003 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3115 -1.0741 1.7625 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0442 -4.4693 -2.2911 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5857 -4.1275 -1.8765 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5215 -3.4297 1.4814 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9032 -0.1956 -1.1949 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4027 1.2145 -2.0935 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9292 -2.8522 1.6416 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4859 2.5833 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1950 0.9474 -1.1337 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8944 1.7665 0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4837 1.7115 1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9912 3.5059 0.1689 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6308 3.2477 2.8212 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8717 4.1553 2.2688 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
2 17 2 0 0 0 0
3 9 1 0 0 0 0
3 11 1 0 0 0 0
3 13 1 0 0 0 0
4 14 1 0 0 0 0
4 17 1 0 0 0 0
4 18 1 0 0 0 0
5 8 1 0 0 0 0
5 36 1 0 0 0 0
5 37 1 0 0 0 0
6 15 1 0 0 0 0
6 17 1 0 0 0 0
6 20 1 0 0 0 0
7 15 2 0 0 0 0
7 19 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 27 1 0 0 0 0
9 28 1 0 0 0 0
9 29 1 0 0 0 0
10 12 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 12 1 0 0 0 0
11 32 1 0 0 0 0
11 33 1 0 0 0 0
12 34 1 0 0 0 0
12 35 1 0 0 0 0
13 14 2 0 0 0 0
13 16 1 0 0 0 0
14 15 1 0 0 0 0
16 19 2 0 0 0 0
16 38 1 0 0 0 0
18 21 1 0 0 0 0
18 39 1 0 0 0 0
18 40 1 0 0 0 0
19 41 1 0 0 0 0
20 42 1 0 0 0 0
20 43 1 0 0 0 0
20 44 1 0 0 0 0
21 22 1 0 0 0 0
21 23 2 0 0 0 0
22 24 2 0 0 0 0
23 25 1 0 0 0 0
23 45 1 0 0 0 0
24 26 1 0 0 0 0
24 46 1 0 0 0 0
25 26 2 0 0 0 0
25 47 1 0 0 0 0
26 48 1 0 0 0 0
M END
$$$$