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1 mol 0 unq 0 iso 1 dist 9.99338 15.247 9.07223 14.9294 8.13129 7.19817 numMergedOcc 0
2 mol 0 unq 0 iso 2 dist 8.13129 14.9294 9.99338 7.19817 9.07223 15.247 numMergedOcc 0
3 mol 0 unq 0 iso 3 dist 8.13129 7.19817 9.07223 14.9294 9.99338 15.247 numMergedOcc 0
4 mol 0 unq 0 iso 4 dist 9.07223 15.247 9.99338 7.19817 8.13129 14.9294 numMergedOcc 0
5 mol 0 unq 0 iso 5 dist 9.07223 7.19817 8.13129 15.247 9.99338 14.9294 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 7.5706 9.0379 6.28925 15.4949 8.70159 13.2247 numMergedOcc 0
7 mol 7 unq 0 iso 1 dist 7.5706 15.4949 8.70159 9.0379 6.28925 13.2247 numMergedOcc 0
8 mol 7 unq 0 iso 2 dist 6.28925 9.0379 7.5706 13.2247 8.70159 15.4949 numMergedOcc 0
9 mol 7 unq 0 iso 3 dist 6.28925 13.2247 8.70159 9.0379 7.5706 15.4949 numMergedOcc 0
10 mol 7 unq 0 iso 4 dist 8.70159 15.4949 7.5706 13.2247 6.28925 9.0379 numMergedOcc 0
11 mol 7 unq 0 iso 5 dist 8.70159 13.2247 6.28925 15.4949 7.5706 9.0379 numMergedOcc 0
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13 mol 30 unq 0 iso 1 dist 5.61656 5.34368 6.95343 5.03351 8.67487 6.89466 numMergedOcc 0
14 mol 30 unq 0 iso 2 dist 8.67487 5.03351 5.61656 6.89466 6.95343 5.34368 numMergedOcc 0
15 mol 30 unq 0 iso 3 dist 8.67487 6.89466 6.95343 5.03351 5.61656 5.34368 numMergedOcc 0
16 mol 30 unq 0 iso 4 dist 6.95343 5.34368 5.61656 6.89466 8.67487 5.03351 numMergedOcc 0
17 mol 30 unq 0 iso 5 dist 6.95343 6.89466 8.67487 5.34368 5.61656 5.03351 numMergedOcc 0
18 mol 43 unq 0 iso 0 dist 8.92291 5.06502 6.79185 5.89973 8.37962 6.45462 numMergedOcc 0
19 mol 43 unq 0 iso 1 dist 8.92291 5.89973 8.37962 5.06502 6.79185 6.45462 numMergedOcc 0
20 mol 43 unq 0 iso 2 dist 6.79185 5.06502 8.92291 6.45462 8.37962 5.89973 numMergedOcc 0
21 mol 43 unq 0 iso 3 dist 6.79185 6.45462 8.37962 5.06502 8.92291 5.89973 numMergedOcc 0
22 mol 43 unq 0 iso 4 dist 8.37962 5.89973 8.92291 6.45462 6.79185 5.06502 numMergedOcc 0
23 mol 43 unq 0 iso 5 dist 8.37962 6.45462 6.79185 5.89973 8.92291 5.06502 numMergedOcc 0
24 mol 73 unq 0 iso 0 dist 9.33919 5.4148 9.79143 14.9342 6.43377 13.3558 numMergedOcc 0
25 mol 73 unq 0 iso 1 dist 9.33919 14.9342 6.43377 5.4148 9.79143 13.3558 numMergedOcc 0
26 mol 73 unq 0 iso 2 dist 9.79143 5.4148 9.33919 13.3558 6.43377 14.9342 numMergedOcc 0
27 mol 73 unq 0 iso 3 dist 9.79143 13.3558 6.43377 5.4148 9.33919 14.9342 numMergedOcc 0
28 mol 73 unq 0 iso 4 dist 6.43377 14.9342 9.33919 13.3558 9.79143 5.4148 numMergedOcc 0
29 mol 73 unq 0 iso 5 dist 6.43377 13.3558 9.79143 14.9342 9.33919 5.4148 numMergedOcc 0
30 mol 86 unq 0 iso 0 dist 7.73058 12.6999 6.81209 9.22735 8.54122 7.03817 numMergedOcc 0
31 mol 86 unq 0 iso 1 dist 7.73058 9.22735 8.54122 12.6999 6.81209 7.03817 numMergedOcc 0
32 mol 86 unq 0 iso 2 dist 6.81209 12.6999 7.73058 7.03817 8.54122 9.22735 numMergedOcc 0
33 mol 86 unq 0 iso 3 dist 6.81209 7.03817 8.54122 12.6999 7.73058 9.22735 numMergedOcc 0
34 mol 86 unq 0 iso 4 dist 8.54122 9.22735 7.73058 7.03817 6.81209 12.6999 numMergedOcc 0
35 mol 86 unq 0 iso 5 dist 8.54122 7.03817 6.81209 9.22735 7.73058 12.6999 numMergedOcc 0
36 mol 88 unq 0 iso 0 dist 9.30559 13.5016 5.96359 11.8813 7.48974 4.96064 numMergedOcc 0
37 mol 88 unq 0 iso 1 dist 9.30559 11.8813 7.48974 13.5016 5.96359 4.96064 numMergedOcc 0
38 mol 88 unq 0 iso 2 dist 5.96359 13.5016 9.30559 4.96064 7.48974 11.8813 numMergedOcc 0
39 mol 88 unq 0 iso 3 dist 5.96359 4.96064 7.48974 13.5016 9.30559 11.8813 numMergedOcc 0
40 mol 88 unq 0 iso 4 dist 7.48974 11.8813 9.30559 4.96064 5.96359 13.5016 numMergedOcc 0
41 mol 88 unq 0 iso 5 dist 7.48974 4.96064 5.96359 11.8813 9.30559 13.5016 numMergedOcc 0
42 mol 88 unq 1 iso 0 dist 9.30559 13.5016 5.96359 11.6198 8.40428 8.62396 numMergedOcc 0
43 mol 88 unq 1 iso 1 dist 9.30559 11.6198 8.40428 13.5016 5.96359 8.62396 numMergedOcc 0
44 mol 88 unq 1 iso 2 dist 5.96359 13.5016 9.30559 8.62396 8.40428 11.6198 numMergedOcc 0
45 mol 88 unq 1 iso 3 dist 5.96359 8.62396 8.40428 13.5016 9.30559 11.6198 numMergedOcc 0
46 mol 88 unq 1 iso 4 dist 8.40428 11.6198 9.30559 8.62396 5.96359 13.5016 numMergedOcc 0
47 mol 88 unq 1 iso 5 dist 8.40428 8.62396 5.96359 11.6198 9.30559 13.5016 numMergedOcc 0
48 mol 88 unq 1 iso 0 dist 9.30559 11.8813 7.48974 11.6198 8.40428 5.05664 numMergedOcc 0
49 mol 88 unq 1 iso 1 dist 9.30559 11.6198 8.40428 11.8813 7.48974 5.05664 numMergedOcc 0
50 mol 88 unq 1 iso 2 dist 7.48974 11.8813 9.30559 5.05664 8.40428 11.6198 numMergedOcc 0
51 mol 88 unq 1 iso 3 dist 7.48974 5.05664 8.40428 11.8813 9.30559 11.6198 numMergedOcc 0
52 mol 88 unq 1 iso 4 dist 8.40428 11.6198 9.30559 5.05664 7.48974 11.8813 numMergedOcc 0
53 mol 88 unq 1 iso 5 dist 8.40428 5.05664 7.48974 11.6198 9.30559 11.8813 numMergedOcc 0
54 mol 88 unq 2 iso 0 dist 6.066 5.57085 9.36032 9.94966 8.3592 10.9968 numMergedOcc 0
55 mol 88 unq 2 iso 1 dist 6.066 9.94966 8.3592 5.57085 9.36032 10.9968 numMergedOcc 0
56 mol 88 unq 2 iso 2 dist 9.36032 5.57085 6.066 10.9968 8.3592 9.94966 numMergedOcc 0
57 mol 88 unq 2 iso 3 dist 9.36032 10.9968 8.3592 5.57085 6.066 9.94966 numMergedOcc 0
58 mol 88 unq 2 iso 4 dist 8.3592 9.94966 6.066 10.9968 9.36032 5.57085 numMergedOcc 0
59 mol 88 unq 2 iso 5 dist 8.3592 10.9968 9.36032 9.94966 6.066 5.57085 numMergedOcc 0
60 mol 88 unq 1 iso 0 dist 5.96359 4.96064 7.48974 8.62396 8.40428 5.05664 numMergedOcc 0
61 mol 88 unq 1 iso 1 dist 5.96359 8.62396 8.40428 4.96064 7.48974 5.05664 numMergedOcc 0
62 mol 88 unq 1 iso 2 dist 7.48974 4.96064 5.96359 5.05664 8.40428 8.62396 numMergedOcc 0
63 mol 88 unq 1 iso 3 dist 7.48974 5.05664 8.40428 4.96064 5.96359 8.62396 numMergedOcc 0
64 mol 88 unq 1 iso 4 dist 8.40428 8.62396 5.96359 5.05664 7.48974 4.96064 numMergedOcc 0
65 mol 88 unq 1 iso 5 dist 8.40428 5.05664 7.48974 8.62396 5.96359 4.96064 numMergedOcc 0
66 mol 110 unq 0 iso 0 dist 9.11812 5.00116 6.78225 8.3284 6.2967 4.56913 numMergedOcc 0
67 mol 110 unq 0 iso 1 dist 9.11812 8.3284 6.2967 5.00116 6.78225 4.56913 numMergedOcc 0
68 mol 110 unq 0 iso 2 dist 6.78225 5.00116 9.11812 4.56913 6.2967 8.3284 numMergedOcc 0
69 mol 110 unq 0 iso 3 dist 6.78225 4.56913 6.2967 5.00116 9.11812 8.3284 numMergedOcc 0
70 mol 110 unq 0 iso 4 dist 6.2967 8.3284 9.11812 4.56913 6.78225 5.00116 numMergedOcc 0
71 mol 110 unq 0 iso 5 dist 6.2967 4.56913 6.78225 8.3284 9.11812 5.00116 numMergedOcc 0
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73 mol 183 unq 0 iso 1 dist 7.24772 7.09808 9.75243 6.64382 7.89803 8.1508 numMergedOcc 0
74 mol 183 unq 0 iso 2 dist 7.89803 6.64382 7.24772 8.1508 9.75243 7.09808 numMergedOcc 0
75 mol 183 unq 0 iso 3 dist 7.89803 8.1508 9.75243 6.64382 7.24772 7.09808 numMergedOcc 0
76 mol 183 unq 0 iso 4 dist 9.75243 7.09808 7.24772 8.1508 7.89803 6.64382 numMergedOcc 0
77 mol 183 unq 0 iso 5 dist 9.75243 8.1508 7.89803 7.09808 7.24772 6.64382 numMergedOcc 0
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79 mol 219 unq 0 iso 1 dist 5.40597 13.4387 8.69579 7.02195 7.66784 10.7348 numMergedOcc 0
80 mol 219 unq 0 iso 2 dist 7.66784 7.02195 5.40597 10.7348 8.69579 13.4387 numMergedOcc 0
81 mol 219 unq 0 iso 3 dist 7.66784 10.7348 8.69579 7.02195 5.40597 13.4387 numMergedOcc 0
82 mol 219 unq 0 iso 4 dist 8.69579 13.4387 5.40597 10.7348 7.66784 7.02195 numMergedOcc 0
83 mol 219 unq 0 iso 5 dist 8.69579 10.7348 7.66784 13.4387 5.40597 7.02195 numMergedOcc 0
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85 mol 219 unq 1 iso 1 dist 5.40597 10.8119 6.71733 7.02195 7.66784 10.6748 numMergedOcc 0
86 mol 219 unq 1 iso 2 dist 7.66784 7.02195 5.40597 10.6748 6.71733 10.8119 numMergedOcc 0
87 mol 219 unq 1 iso 3 dist 7.66784 10.6748 6.71733 7.02195 5.40597 10.8119 numMergedOcc 0
88 mol 219 unq 1 iso 4 dist 6.71733 10.8119 5.40597 10.6748 7.66784 7.02195 numMergedOcc 0
89 mol 219 unq 1 iso 5 dist 6.71733 10.6748 7.66784 10.8119 5.40597 7.02195 numMergedOcc 0
90 mol 219 unq 1 iso 0 dist 5.40597 13.4387 8.69579 10.8119 6.71733 6.74494 numMergedOcc 0
91 mol 219 unq 1 iso 1 dist 5.40597 10.8119 6.71733 13.4387 8.69579 6.74494 numMergedOcc 0
92 mol 219 unq 1 iso 2 dist 8.69579 13.4387 5.40597 6.74494 6.71733 10.8119 numMergedOcc 0
93 mol 219 unq 1 iso 3 dist 8.69579 6.74494 6.71733 13.4387 5.40597 10.8119 numMergedOcc 0
94 mol 219 unq 1 iso 4 dist 6.71733 10.8119 5.40597 6.74494 8.69579 13.4387 numMergedOcc 0
95 mol 219 unq 1 iso 5 dist 6.71733 6.74494 8.69579 10.8119 5.40597 13.4387 numMergedOcc 0
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97 mol 219 unq 1 iso 1 dist 7.66784 10.6748 6.71733 10.7348 8.69579 6.74494 numMergedOcc 0
98 mol 219 unq 1 iso 2 dist 8.69579 10.7348 7.66784 6.74494 6.71733 10.6748 numMergedOcc 0
99 mol 219 unq 1 iso 3 dist 8.69579 6.74494 6.71733 10.7348 7.66784 10.6748 numMergedOcc 0
100 mol 219 unq 1 iso 4 dist 6.71733 10.6748 7.66784 6.74494 8.69579 10.7348 numMergedOcc 0
101 mol 219 unq 1 iso 5 dist 6.71733 6.74494 8.69579 10.6748 7.66784 10.7348 numMergedOcc 0
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103 mol 225 unq 0 iso 1 dist 8.25629 16.718 9.20561 12.0157 9.31373 15.3446 numMergedOcc 0
104 mol 225 unq 0 iso 2 dist 9.31373 12.0157 8.25629 15.3446 9.20561 16.718 numMergedOcc 0
105 mol 225 unq 0 iso 3 dist 9.31373 15.3446 9.20561 12.0157 8.25629 16.718 numMergedOcc 0
106 mol 225 unq 0 iso 4 dist 9.20561 16.718 8.25629 15.3446 9.31373 12.0157 numMergedOcc 0
107 mol 225 unq 0 iso 5 dist 9.20561 15.3446 9.31373 16.718 8.25629 12.0157 numMergedOcc 0
108 mol 225 unq 1 iso 0 dist 8.25629 12.0157 9.31373 12.5593 9.88976 13.3965 numMergedOcc 0
109 mol 225 unq 1 iso 1 dist 8.25629 12.5593 9.88976 12.0157 9.31373 13.3965 numMergedOcc 0
110 mol 225 unq 1 iso 2 dist 9.31373 12.0157 8.25629 13.3965 9.88976 12.5593 numMergedOcc 0
111 mol 225 unq 1 iso 3 dist 9.31373 13.3965 9.88976 12.0157 8.25629 12.5593 numMergedOcc 0
112 mol 225 unq 1 iso 4 dist 9.88976 12.5593 8.25629 13.3965 9.31373 12.0157 numMergedOcc 0
113 mol 225 unq 1 iso 5 dist 9.88976 13.3965 9.31373 12.5593 8.25629 12.0157 numMergedOcc 0
114 mol 225 unq 1 iso 0 dist 8.25629 16.718 9.20561 12.5593 9.88976 16.5576 numMergedOcc 0
115 mol 225 unq 1 iso 1 dist 8.25629 12.5593 9.88976 16.718 9.20561 16.5576 numMergedOcc 0
116 mol 225 unq 1 iso 2 dist 9.20561 16.718 8.25629 16.5576 9.88976 12.5593 numMergedOcc 0
117 mol 225 unq 1 iso 3 dist 9.20561 16.5576 9.88976 16.718 8.25629 12.5593 numMergedOcc 0
118 mol 225 unq 1 iso 4 dist 9.88976 12.5593 8.25629 16.5576 9.20561 16.718 numMergedOcc 0
119 mol 225 unq 1 iso 5 dist 9.88976 16.5576 9.20561 12.5593 8.25629 16.718 numMergedOcc 0
120 mol 225 unq 1 iso 0 dist 9.31373 15.3446 9.20561 13.3965 9.88976 16.5576 numMergedOcc 0
121 mol 225 unq 1 iso 1 dist 9.31373 13.3965 9.88976 15.3446 9.20561 16.5576 numMergedOcc 0
122 mol 225 unq 1 iso 2 dist 9.20561 15.3446 9.31373 16.5576 9.88976 13.3965 numMergedOcc 0
123 mol 225 unq 1 iso 3 dist 9.20561 16.5576 9.88976 15.3446 9.31373 13.3965 numMergedOcc 0
124 mol 225 unq 1 iso 4 dist 9.88976 13.3965 9.31373 16.5576 9.20561 15.3446 numMergedOcc 0
125 mol 225 unq 1 iso 5 dist 9.88976 16.5576 9.20561 13.3965 9.31373 15.3446 numMergedOcc 0
126 mol 234 unq 0 iso 0 dist 7.72403 5.88703 6.35438 15.2225 9.57132 10.2693 numMergedOcc 0
127 mol 234 unq 0 iso 1 dist 7.72403 15.2225 9.57132 5.88703 6.35438 10.2693 numMergedOcc 0
128 mol 234 unq 0 iso 2 dist 6.35438 5.88703 7.72403 10.2693 9.57132 15.2225 numMergedOcc 0
129 mol 234 unq 0 iso 3 dist 6.35438 10.2693 9.57132 5.88703 7.72403 15.2225 numMergedOcc 0
130 mol 234 unq 0 iso 4 dist 9.57132 15.2225 7.72403 10.2693 6.35438 5.88703 numMergedOcc 0
131 mol 234 unq 0 iso 5 dist 9.57132 10.2693 6.35438 15.2225 7.72403 5.88703 numMergedOcc 0
