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1 mol 16 unq 0 iso 0 dist 6.58035 8.41862 10.9633 10.7015 7.03948 17.3012 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 6.58035 8.41862 10.9633 5.32694 5.47769 13.0191 numMergedOcc 0
3 mol 16 unq 2 iso 0 dist 8.41862 6.58035 10.9633 5.74188 8.16785 12.1189 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.23643 8.78293 12.7954 5.03957 8.73972 12.6444 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 8.23643 7.82528 11.0033 5.03957 8.73972 10.2708 numMergedOcc 0
6 mol 19 unq 2 iso 0 dist 7.82528 8.78293 14.7664 10.8007 6.00439 19.07 numMergedOcc 0
7 mol 19 unq 3 iso 0 dist 7.82528 8.78293 14.7664 7.67038 6.20943 13.4721 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 7.82528 8.23643 11.0033 10.8007 6.00439 14.2119 numMergedOcc 0
9 mol 19 unq 5 iso 0 dist 7.82528 8.23643 11.0033 7.67038 6.20943 14.6255 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 6.46761 7.58407 6.44201 10.8153 8.63333 14.2147 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 6.46761 7.58407 6.44201 8.62958 8.89374 14.3086 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 6.46761 7.58407 6.44201 6.47414 9.73139 6.31428 numMergedOcc 0
13 mol 58 unq 3 iso 0 dist 7.58407 6.46761 6.44201 11.0466 6.40841 10.9482 numMergedOcc 0
14 mol 58 unq 4 iso 0 dist 7.58407 6.46761 6.44201 6.47414 6.31428 9.73139 numMergedOcc 0
15 mol 58 unq 5 iso 0 dist 9.73139 6.31428 6.44201 14.5953 8.63333 14.2147 numMergedOcc 0
16 mol 58 unq 6 iso 0 dist 9.73139 6.31428 6.44201 14.176 8.89374 14.3086 numMergedOcc 0
17 mol 58 unq 7 iso 0 dist 9.73139 6.31428 6.44201 6.47414 6.46761 7.58407 numMergedOcc 0
18 mol 58 unq 8 iso 0 dist 6.31428 9.73139 6.44201 5.90225 6.40841 10.9482 numMergedOcc 0
19 mol 58 unq 9 iso 0 dist 6.31428 9.73139 6.44201 6.47414 7.58407 6.46761 numMergedOcc 0
20 mol 64 unq 0 iso 0 dist 9.54144 9.80142 6.23335 10.6748 8.68586 13.3487 numMergedOcc 0
21 mol 70 unq 0 iso 0 dist 7.92394 9.93423 4.25121 5.22626 8.33704 11.6205 numMergedOcc 0
22 mol 70 unq 1 iso 0 dist 7.92394 9.34122 13.6636 5.22626 8.33704 13.4942 numMergedOcc 0
23 mol 76 unq 0 iso 0 dist 8.19682 8.97793 5.67347 10.2879 6.21982 11.062 numMergedOcc 0
24 mol 87 unq 0 iso 0 dist 7.51358 8.93296 8.12939 7.40574 8.32298 14.2495 numMergedOcc 0
25 mol 115 unq 0 iso 0 dist 9.66954 7.64585 12.0796 7.69052 8.66155 12.2309 numMergedOcc 0
26 mol 119 unq 0 iso 0 dist 6.19042 9.38288 6.59581 9.22558 8.43904 14.332 numMergedOcc 0
27 mol 119 unq 1 iso 0 dist 6.19042 7.44174 8.58342 9.22558 8.43904 13.4411 numMergedOcc 0
28 mol 119 unq 2 iso 0 dist 7.44174 9.38288 11.6138 11.3169 7.39889 17.0377 numMergedOcc 0
29 mol 119 unq 3 iso 0 dist 7.44174 9.38288 11.6138 12.4603 9.63176 19.596 numMergedOcc 0
30 mol 119 unq 4 iso 0 dist 7.44174 6.19042 8.58342 11.3169 7.39889 15.1819 numMergedOcc 0
31 mol 119 unq 5 iso 0 dist 7.44174 6.19042 8.58342 12.4603 9.63176 14.0269 numMergedOcc 0
32 mol 119 unq 6 iso 0 dist 8.43904 9.80862 4.84196 9.22558 6.19042 10.2144 numMergedOcc 0
33 mol 127 unq 0 iso 0 dist 8.59981 7.34519 12.7129 11.279 6.192 16.5965 numMergedOcc 0
34 mol 127 unq 1 iso 0 dist 8.59981 7.34519 12.7129 11.4958 7.69308 18.1066 numMergedOcc 0
35 mol 127 unq 2 iso 0 dist 8.59981 7.34519 12.7129 5.55757 7.66331 8.58999 numMergedOcc 0
36 mol 127 unq 3 iso 0 dist 7.66331 8.58999 12.7129 8.77327 6.192 16.5965 numMergedOcc 0
37 mol 127 unq 4 iso 0 dist 7.66331 8.58999 12.7129 11.521 7.69308 18.1066 numMergedOcc 0
38 mol 127 unq 5 iso 0 dist 7.66331 8.58999 12.7129 5.55757 8.59981 7.34519 numMergedOcc 0
39 mol 127 unq 6 iso 0 dist 7.34519 8.59981 12.7129 5.55757 8.58999 7.66331 numMergedOcc 0
40 mol 127 unq 7 iso 0 dist 7.34519 8.59981 12.7129 6.16471 6.63981 11.7596 numMergedOcc 0
41 mol 127 unq 8 iso 0 dist 8.58999 7.66331 12.7129 5.55757 7.34519 8.59981 numMergedOcc 0
42 mol 127 unq 9 iso 0 dist 8.58999 7.66331 12.7129 4.48524 6.63981 11.7596 numMergedOcc 0
43 mol 130 unq 0 iso 0 dist 7.66168 9.12581 6.09983 7.01619 6.79146 11.9081 numMergedOcc 0
44 mol 130 unq 1 iso 0 dist 7.66168 9.12581 6.09983 7.50049 6.89257 8.74308 numMergedOcc 0
45 mol 130 unq 2 iso 0 dist 6.89257 8.74308 6.09983 6.83397 6.79146 11.9081 numMergedOcc 0
46 mol 130 unq 3 iso 0 dist 6.89257 8.74308 6.09983 7.50049 7.66168 9.12581 numMergedOcc 0
47 mol 130 unq 4 iso 0 dist 9.12581 7.66168 6.09983 7.50049 8.74308 6.89257 numMergedOcc 0
48 mol 130 unq 5 iso 0 dist 8.74308 6.89257 6.09983 7.50049 9.12581 7.66168 numMergedOcc 0
49 mol 131 unq 0 iso 0 dist 6.91348 9.51418 10.2027 6.63273 8.6243 12.9472 numMergedOcc 0
50 mol 155 unq 0 iso 0 dist 9.87281 8.65888 10.1369 10.6882 9.17284 14.592 numMergedOcc 0
51 mol 155 unq 1 iso 0 dist 9.87281 8.65888 10.1369 4.66274 8.87452 10.5792 numMergedOcc 0
52 mol 155 unq 2 iso 0 dist 9.87281 8.27111 6.0706 10.6882 9.17284 13.2459 numMergedOcc 0
53 mol 155 unq 3 iso 0 dist 9.87281 8.27111 6.0706 4.66274 8.87452 7.68368 numMergedOcc 0
54 mol 155 unq 4 iso 0 dist 8.87452 7.68368 6.0706 12.1545 9.17284 13.2459 numMergedOcc 0
55 mol 155 unq 5 iso 0 dist 8.87452 7.68368 6.0706 4.66274 9.87281 8.27111 numMergedOcc 0
56 mol 155 unq 6 iso 0 dist 7.16254 9.86313 7.63368 5.71071 9.14392 7.51198 numMergedOcc 0
57 mol 155 unq 7 iso 0 dist 9.86313 7.16254 7.63368 5.71071 7.51198 9.14392 numMergedOcc 0
58 mol 155 unq 8 iso 0 dist 9.14392 7.51198 7.63368 5.71071 7.16254 9.86313 numMergedOcc 0
59 mol 155 unq 9 iso 0 dist 7.51198 9.14392 7.63368 5.71071 9.86313 7.16254 numMergedOcc 0
60 mol 155 unq 10 iso 0 dist 7.39644 7.70572 9.42764 10.7616 7.36102 14.545 numMergedOcc 0
61 mol 155 unq 11 iso 0 dist 7.36102 9.38946 5.68272 10.7616 7.39644 11.5473 numMergedOcc 0
62 mol 155 unq 12 iso 0 dist 8.65888 9.87281 10.1369 7.01918 7.70572 12.0728 numMergedOcc 0
63 mol 155 unq 13 iso 0 dist 8.65888 8.27111 5.44147 7.01918 7.70572 10.6403 numMergedOcc 0
64 mol 155 unq 14 iso 0 dist 7.70572 7.39644 9.42764 7.01918 8.65888 13.1369 numMergedOcc 0
65 mol 155 unq 15 iso 0 dist 8.27111 9.87281 6.0706 4.66274 7.68368 8.87452 numMergedOcc 0
66 mol 155 unq 16 iso 0 dist 8.27111 8.65888 5.44147 4.66274 7.68368 10.5792 numMergedOcc 0
67 mol 155 unq 17 iso 0 dist 7.68368 8.87452 6.0706 4.66274 8.27111 9.87281 numMergedOcc 0
68 mol 213 unq 0 iso 0 dist 9.59129 6.0965 6.04429 13.7995 8.45368 11.0791 numMergedOcc 0
69 mol 218 unq 0 iso 0 dist 7.17547 7.18041 9.17818 7.83217 7.13323 13.9223 numMergedOcc 0
70 mol 218 unq 1 iso 0 dist 7.13323 9.50586 4.63933 7.83217 7.17547 9.29802 numMergedOcc 0
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74 mol 228 unq 1 iso 0 dist 8.06181 9.42615 8.57673 11.1899 7.65132 14.9859 numMergedOcc 0
75 mol 228 unq 2 iso 0 dist 8.06181 9.42615 8.57673 5.93014 8.53764 13.6165 numMergedOcc 0
76 mol 228 unq 3 iso 0 dist 7.77367 9.06121 8.22089 5.42695 8.20909 12.4332 numMergedOcc 0
77 mol 228 unq 4 iso 0 dist 7.77367 9.06121 8.22089 11.3702 7.94506 14.7666 numMergedOcc 0
78 mol 228 unq 5 iso 0 dist 7.77367 9.06121 8.22089 6.001 8.15494 13.3068 numMergedOcc 0
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83 mol 238 unq 2 iso 0 dist 6.55759 7.19008 12.1411 5.42006 5.38637 12.0365 numMergedOcc 0
84 mol 238 unq 3 iso 0 dist 7.02475 6.55759 6.44245 12.9854 8.96531 13.9201 numMergedOcc 0
85 mol 238 unq 4 iso 0 dist 7.02475 7.67322 5.44694 12.9854 8.96531 10.0552 numMergedOcc 0
86 mol 238 unq 5 iso 0 dist 7.02475 7.19008 10.1756 12.9854 8.96531 10.0962 numMergedOcc 0
87 mol 238 unq 6 iso 0 dist 9.68513 5.9216 4.83721 10.1648 9.29858 10.7386 numMergedOcc 0
88 mol 238 unq 7 iso 0 dist 5.9216 9.68513 4.83721 5.40359 9.90142 12.5477 numMergedOcc 0
89 mol 238 unq 8 iso 0 dist 8.14172 8.09066 10.9258 5.31152 6.77463 7.2766 numMergedOcc 0
90 mol 238 unq 9 iso 0 dist 8.09066 8.14172 10.9258 5.6348 6.05141 10.6978 numMergedOcc 0
91 mol 238 unq 10 iso 0 dist 8.09066 8.14172 10.9258 5.31152 7.2766 6.77463 numMergedOcc 0
92 mol 238 unq 11 iso 0 dist 6.77463 7.2766 10.9258 5.31152 8.14172 8.09066 numMergedOcc 0
93 mol 238 unq 12 iso 0 dist 7.2766 6.77463 10.9258 8.87326 6.05141 10.6978 numMergedOcc 0
94 mol 238 unq 13 iso 0 dist 7.2766 6.77463 10.9258 5.31152 8.09066 8.14172 numMergedOcc 0
95 mol 238 unq 14 iso 0 dist 7.19008 6.55759 12.1411 5.34096 7.49471 10.5202 numMergedOcc 0
96 mol 238 unq 15 iso 0 dist 7.19008 7.02475 10.1756 5.34096 7.49471 12.1784 numMergedOcc 0
97 mol 238 unq 16 iso 0 dist 7.19008 7.67322 9.50847 5.34096 7.49471 12.1937 numMergedOcc 0
98 mol 240 unq 0 iso 0 dist 6.15305 8.0951 11.0721 4.28414 7.03489 12.1358 numMergedOcc 0
99 mol 272 unq 0 iso 0 dist 9.09992 6.16449 9.75529 5.40809 6.73206 10.1966 numMergedOcc 0
100 mol 293 unq 0 iso 0 dist 9.47908 9.97212 7.08365 10.9721 8.56847 14.1253 numMergedOcc 0
