ATOM 39
1 N4y N 34.1973 -19.7486
2 C8y C 32.8966 -19.3297
3 C1y C 34.1911 -22.4564
4 C8x C 35.0042 -18.6479
5 C8y C 32.8966 -17.9539
6 N5x N 31.7022 -20.0239
7 O2x O 33.0655 -21.6436
8 C1y C 33.7784 -23.7323
9 N5x N 34.2037 -17.5348
10 C8y C 31.7022 -17.2722
11 C8y C 30.5265 -19.3297
12 C1y C 31.9773 -22.4377
13 C1y C 32.4151 -23.7323
14 O1a O 34.5850 -24.8266
15 N4x N 30.5265 -17.9539
16 O5x O 31.6959 -15.9151
17 N1a N 29.3446 -20.0050
18 C1b C 30.6828 -22.0250
19 O1a O 31.6335 -24.8391
20 O2b O 29.4946 -22.6942
21 P1b P 28.1376 -22.6942
22 O2c O 26.7742 -22.6942
23 O1c O 28.1688 -24.1011
24 O1c O 28.1438 -21.3307
25 P1b P 25.4173 -22.6942
26 O2b O 24.0602 -22.6942
27 O1c O 25.4485 -24.1575
28 O1c O 25.4235 -21.3307
29 C1y C 22.8845 -23.3821
30 O2x O 21.6901 -22.7003
31 C1y C 22.8845 -24.7578
32 C1y C 20.5143 -23.3821
33 C1y C 21.6901 -25.4521
34 O1a O 24.0602 -25.4332
35 C1y C 20.5143 -24.7578
36 C1b C 19.3324 -22.7003
37 O1a O 21.6837 -26.8090
38 O1a O 19.3324 -25.4332
39 O1a O 19.3324 -21.3433
BOND 42
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 1
15 10 16 2
16 11 17 1
17 12 18 1 #Up
18 13 19 1 #Down
19 18 20 1
20 20 21 1
21 21 22 1
22 21 23 1
23 21 24 2
24 22 25 1
25 25 26 1
26 25 27 1
27 25 28 2
28 29 26 1 #Down
29 29 30 1
30 29 31 1
31 30 32 1
32 31 33 1
33 31 34 1
34 32 35 1
35 32 36 1
36 33 37 1
37 35 38 1
38 36 39 1
39 5 9 1
40 11 15 1
41 12 13 1
42 33 35 1
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