ATOM 54
1 C1y C 25.0600 -16.8000
2 C1y C 24.6400 -15.5400
3 C1y C 26.3900 -16.8000
4 O2b O 24.1500 -18.4800
5 O2x O 25.6900 -14.8400
6 C1b C 24.0100 -14.2800
7 C1y C 26.7400 -15.6100
8 O1a O 27.1600 -17.8500
9 P1b P 24.1500 -19.8100
10 O2b O 22.6800 -14.2800
11 R R 28.0000 -15.1900
12 O2b O 26.7400 -19.8100
13 O1c O 24.1500 -21.0700
14 O1c O 22.8200 -19.8100
15 P1b P 20.5800 -14.2800
16 C1b C 28.1400 -19.8100
17 O2b O 20.5800 -12.9500
18 O1c O 20.5800 -15.5400
19 O1c O 19.2500 -14.2800
20 C1y C 29.0500 -21.1400
21 C1y C 20.5800 -11.6900
22 C1y C 29.4700 -22.3300
23 O2x O 30.1000 -20.3700
24 C1y C 20.1600 -10.4300
25 C1y C 21.9100 -11.6900
26 C1y C 30.8000 -22.3300
27 C1y C 31.1500 -21.1400
28 O2x O 21.2100 -9.6600
29 C1y C 22.2600 -10.4300
30 O1a O 22.6800 -12.7400
31 R R 23.5200 -10.0800
32 C1b C 18.8300 -10.0100
33 O1a O 17.7800 -10.9200
34 N4y N 32.4800 -20.7200
35 O7a O 31.9200 -23.7300
36 O1a O 28.2100 -23.4500
37 C8y C 33.6058 -21.5522
38 C8y C 34.7452 -20.7387
39 N5x N 34.3236 -19.4037
40 C8x C 32.9236 -19.3921
41 N5x N 33.7406 -22.9457
42 C8x C 35.0148 -23.5257
43 N5x N 36.1542 -22.7122
44 C8y C 36.0194 -21.3187
45 N1a N 37.1636 -20.5016
46 C7a C 31.9200 -25.1300
47 O6a O 30.7076 -25.8300
48 C1c C 33.1324 -25.8300
49 C1b C 34.3279 -25.1396
50 C1b C 35.5153 -25.8251
51 C6a C 36.7065 -25.1371
52 O6a O 37.8960 -25.8238
53 O6a O 36.7065 -23.7303
54 N1a N 33.1325 -27.2298
BOND 58
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 6 10 1
10 7 11 1 #Up
11 9 12 1
12 9 13 1
13 9 14 2
14 10 15 1
15 12 16 1
16 15 17 1
17 15 18 1
18 15 19 2
19 20 16 1 #Up
20 21 17 1 #Down
21 20 22 1
22 20 23 1
23 21 24 1
24 21 25 1
25 22 26 1
26 23 27 1
27 24 28 1
28 25 29 1
29 25 30 1 #Down
30 29 31 1 #Up
31 5 7 1
32 26 27 1
33 28 29 1
34 24 32 1 #Up
35 32 33 1
36 27 34 1 #Up
37 26 35 1 #Down
38 22 36 1 #Down
39 34 37 1
40 37 38 1
41 38 39 1
42 39 40 2
43 34 40 1
44 37 41 2
45 41 42 1
46 42 43 2
47 43 44 1
48 38 44 2
49 44 45 1
50 35 46 1
51 46 47 2
52 46 48 1
53 48 49 1
54 49 50 1
55 50 51 1
56 51 52 1
57 51 53 2
58 48 54 1 #Down
BRACKET 1 22.0500 -15.1200 22.0500 -13.6500
1 25.1300 -19.0400 25.1300 -20.5100
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 13 14
REPEAT 1
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