ATOM 37
1 C7a C 19.8956 -20.0534
2 O7a O 21.1207 -20.7580
3 O6a O 19.8956 -18.6445
4 C1a C 18.6740 -20.7587
5 O2a O 27.1562 -19.9163
6 C1y C 25.9383 -20.7984
7 O2x O 24.7411 -20.0933
8 C1y C 26.0004 -22.1937
9 C1y C 23.5311 -20.7845
10 C1y C 24.7255 -22.8837
11 O7a O 27.1589 -22.9007
12 C1y C 23.5235 -22.1798
13 C1b C 22.3288 -20.0873
14 O7a O 24.7228 -24.2818
15 O7a O 22.3132 -22.8778
16 C7a C 28.3842 -23.5886
17 O6a O 28.3163 -24.9940
18 C1a C 29.5948 -22.8906
19 C7a C 24.7269 -25.6819
20 O6a O 23.5127 -26.3701
21 C1a C 25.9300 -26.3765
22 C7a C 21.0937 -23.5661
23 O6a O 19.8873 -22.8654
24 C1a C 21.0839 -24.9630
25 C1y C 27.1653 -18.0247
26 C1y C 25.9830 -17.3226
27 C1y C 25.9830 -15.9484
28 C1y C 24.6741 -17.7472
29 C2y C 27.1635 -15.2695
30 C1x C 24.6800 -15.5355
31 O2x O 28.3548 -17.3226
32 C1x C 23.8843 -16.6262
33 C1a C 24.2565 -19.0329
34 C2x C 28.3548 -15.9484
35 C6a C 27.1577 -13.9069
36 O6a O 28.3372 -13.2417
37 O6a O 25.9713 -13.2476
BOND 39
1 19 14 1
2 19 20 2
3 8 11 1 #Down
4 19 21 1
5 9 12 1
6 9 13 1 #Up
7 22 15 1
8 22 23 2
9 10 14 1 #Up
10 22 24 1
11 12 15 1 #Down
12 25 5 1 #Up
13 10 12 1
14 13 2 1
15 6 5 1 #Up
16 6 7 1
17 6 8 1
18 7 9 1
19 1 4 1
20 1 2 1
21 16 11 1
22 16 17 2
23 1 3 2
24 16 18 1
25 8 10 1
26 26 27 1
27 26 25 1
28 26 28 1
29 27 29 1
30 27 30 1
31 25 31 1
32 28 32 1
33 28 33 1 #Up
34 29 34 2
35 29 35 1
36 35 36 1
37 35 37 2
38 30 32 1
39 31 34 1
| 
