0 mol 5 unq 0 iso 0 dist 9.45559 9.59917 7.74636 8.41594 7.64769 5.31713 12.663 8.31759 7.84244 4.73885 numMergedOcc 0
1 mol 5 unq 0 iso 1 dist 9.45559 9.59917 7.74636 12.663 8.31759 7.84244 8.41594 7.64769 5.31713 4.73885 numMergedOcc 0
2 mol 5 unq 1 iso 0 dist 7.4332 8.94762 8.34817 8.41594 9.70883 13.2371 11.6739 9.65565 3.24598 16.0393 numMergedOcc 0
3 mol 5 unq 1 iso 1 dist 7.4332 8.94762 8.34817 11.6739 9.65565 3.24598 8.41594 9.70883 13.2371 16.0393 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 7.7871 11.0435 9.2146 11.1346 8.53424 16.4255 10.8275 7.08766 16.0765 3.70336 numMergedOcc 0
5 mol 28 unq 0 iso 1 dist 7.7871 11.0435 9.2146 10.8275 7.08766 16.0765 11.1346 8.53424 16.4255 3.70336 numMergedOcc 0
6 mol 28 unq 1 iso 0 dist 7.7871 11.0435 9.2146 11.1346 8.53424 16.4255 7.90018 4.82199 13.6412 5.1533 numMergedOcc 0
7 mol 28 unq 1 iso 1 dist 7.7871 11.0435 9.2146 7.90018 4.82199 13.6412 11.1346 8.53424 16.4255 5.1533 numMergedOcc 0
8 mol 28 unq 1 iso 0 dist 7.7871 11.0435 9.2146 10.8275 7.08766 16.0765 7.90018 4.82199 13.6412 3.0988 numMergedOcc 0
9 mol 28 unq 1 iso 1 dist 7.7871 11.0435 9.2146 7.90018 4.82199 13.6412 10.8275 7.08766 16.0765 3.0988 numMergedOcc 0
10 mol 30 unq 0 iso 0 dist 7.88072 4.5844 8.67216 4.83638 9.63882 3.08756 5.2103 6.87277 3.30447 6.09772 numMergedOcc 0
11 mol 30 unq 0 iso 1 dist 7.88072 4.5844 8.67216 5.2103 6.87277 3.30447 4.83638 9.63882 3.08756 6.09772 numMergedOcc 0
12 mol 48 unq 0 iso 0 dist 8.26877 12.0497 7.78689 5.39197 8.22812 9.26377 9.53255 4.22002 4.88527 6.87266 numMergedOcc 0
13 mol 48 unq 0 iso 1 dist 8.26877 12.0497 7.78689 9.53255 4.22002 4.88527 5.39197 8.22812 9.26377 6.87266 numMergedOcc 0
14 mol 48 unq 1 iso 0 dist 8.26877 12.0497 7.78689 5.39197 8.22812 9.26377 7.75132 5.77855 4.76279 4.62605 numMergedOcc 0
15 mol 48 unq 1 iso 1 dist 8.26877 12.0497 7.78689 7.75132 5.77855 4.76279 5.39197 8.22812 9.26377 4.62605 numMergedOcc 0
16 mol 48 unq 2 iso 0 dist 8.26877 12.0497 7.78689 5.39197 8.22812 9.26377 14.2848 8.10774 5.56357 10.9047 numMergedOcc 0
17 mol 48 unq 2 iso 1 dist 8.26877 12.0497 7.78689 14.2848 8.10774 5.56357 5.39197 8.22812 9.26377 10.9047 numMergedOcc 0
18 mol 48 unq 3 iso 0 dist 8.26877 12.0497 7.78689 5.39197 8.22812 9.26377 12.4977 6.5241 9.94951 10.1674 numMergedOcc 0
19 mol 48 unq 3 iso 1 dist 8.26877 12.0497 7.78689 12.4977 6.5241 9.94951 5.39197 8.22812 9.26377 10.1674 numMergedOcc 0
20 mol 48 unq 1 iso 0 dist 8.26877 12.0497 7.78689 9.53255 4.22002 4.88527 7.75132 5.77855 4.76279 3.23184 numMergedOcc 0
21 mol 48 unq 1 iso 1 dist 8.26877 12.0497 7.78689 7.75132 5.77855 4.76279 9.53255 4.22002 4.88527 3.23184 numMergedOcc 0
22 mol 48 unq 2 iso 0 dist 8.26877 12.0497 7.78689 9.53255 4.22002 4.88527 14.2848 8.10774 5.56357 4.78728 numMergedOcc 0
23 mol 48 unq 2 iso 1 dist 8.26877 12.0497 7.78689 14.2848 8.10774 5.56357 9.53255 4.22002 4.88527 4.78728 numMergedOcc 0
24 mol 48 unq 3 iso 0 dist 8.26877 12.0497 7.78689 9.53255 4.22002 4.88527 12.4977 6.5241 9.94951 5.61785 numMergedOcc 0
25 mol 48 unq 3 iso 1 dist 8.26877 12.0497 7.78689 12.4977 6.5241 9.94951 9.53255 4.22002 4.88527 5.61785 numMergedOcc 0
26 mol 48 unq 2 iso 0 dist 8.26877 12.0497 7.78689 7.75132 5.77855 4.76279 14.2848 8.10774 5.56357 7.18912 numMergedOcc 0
27 mol 48 unq 2 iso 1 dist 8.26877 12.0497 7.78689 14.2848 8.10774 5.56357 7.75132 5.77855 4.76279 7.18912 numMergedOcc 0
28 mol 48 unq 3 iso 0 dist 8.26877 12.0497 7.78689 7.75132 5.77855 4.76279 12.4977 6.5241 9.94951 8.43495 numMergedOcc 0
29 mol 48 unq 3 iso 1 dist 8.26877 12.0497 7.78689 12.4977 6.5241 9.94951 7.75132 5.77855 4.76279 8.43495 numMergedOcc 0
30 mol 48 unq 3 iso 0 dist 8.26877 12.0497 7.78689 14.2848 8.10774 5.56357 12.4977 6.5241 9.94951 6.20957 numMergedOcc 0
31 mol 48 unq 3 iso 1 dist 8.26877 12.0497 7.78689 12.4977 6.5241 9.94951 14.2848 8.10774 5.56357 6.20957 numMergedOcc 0
32 mol 48 unq 4 iso 0 dist 7.99434 5.76698 7.78689 12.2756 8.22812 9.26377 8.12843 4.22002 4.88527 6.87266 numMergedOcc 0
33 mol 48 unq 4 iso 1 dist 7.99434 5.76698 7.78689 8.12843 4.22002 4.88527 12.2756 8.22812 9.26377 6.87266 numMergedOcc 0
34 mol 48 unq 5 iso 0 dist 7.99434 5.76698 7.78689 12.2756 8.22812 9.26377 8.16676 5.77855 4.76279 4.62605 numMergedOcc 0
35 mol 48 unq 5 iso 1 dist 7.99434 5.76698 7.78689 8.16676 5.77855 4.76279 12.2756 8.22812 9.26377 4.62605 numMergedOcc 0
36 mol 48 unq 6 iso 0 dist 7.99434 5.76698 7.78689 12.2756 8.22812 9.26377 9.72202 8.10774 5.56357 10.9047 numMergedOcc 0
37 mol 48 unq 6 iso 1 dist 7.99434 5.76698 7.78689 9.72202 8.10774 5.56357 12.2756 8.22812 9.26377 10.9047 numMergedOcc 0
38 mol 48 unq 7 iso 0 dist 7.99434 5.76698 7.78689 12.2756 8.22812 9.26377 12.7252 6.5241 9.94951 10.1674 numMergedOcc 0
39 mol 48 unq 7 iso 1 dist 7.99434 5.76698 7.78689 12.7252 6.5241 9.94951 12.2756 8.22812 9.26377 10.1674 numMergedOcc 0
40 mol 48 unq 5 iso 0 dist 7.99434 5.76698 7.78689 8.12843 4.22002 4.88527 8.16676 5.77855 4.76279 3.23184 numMergedOcc 0
41 mol 48 unq 5 iso 1 dist 7.99434 5.76698 7.78689 8.16676 5.77855 4.76279 8.12843 4.22002 4.88527 3.23184 numMergedOcc 0
42 mol 48 unq 6 iso 0 dist 7.99434 5.76698 7.78689 8.12843 4.22002 4.88527 9.72202 8.10774 5.56357 4.78728 numMergedOcc 0
43 mol 48 unq 6 iso 1 dist 7.99434 5.76698 7.78689 9.72202 8.10774 5.56357 8.12843 4.22002 4.88527 4.78728 numMergedOcc 0
44 mol 48 unq 7 iso 0 dist 7.99434 5.76698 7.78689 8.12843 4.22002 4.88527 12.7252 6.5241 9.94951 5.61785 numMergedOcc 0
45 mol 48 unq 7 iso 1 dist 7.99434 5.76698 7.78689 12.7252 6.5241 9.94951 8.12843 4.22002 4.88527 5.61785 numMergedOcc 0
46 mol 48 unq 6 iso 0 dist 7.99434 5.76698 7.78689 8.16676 5.77855 4.76279 9.72202 8.10774 5.56357 7.18912 numMergedOcc 0
47 mol 48 unq 6 iso 1 dist 7.99434 5.76698 7.78689 9.72202 8.10774 5.56357 8.16676 5.77855 4.76279 7.18912 numMergedOcc 0
48 mol 48 unq 7 iso 0 dist 7.99434 5.76698 7.78689 8.16676 5.77855 4.76279 12.7252 6.5241 9.94951 8.43495 numMergedOcc 0
49 mol 48 unq 7 iso 1 dist 7.99434 5.76698 7.78689 12.7252 6.5241 9.94951 8.16676 5.77855 4.76279 8.43495 numMergedOcc 0
50 mol 48 unq 7 iso 0 dist 7.99434 5.76698 7.78689 9.72202 8.10774 5.56357 12.7252 6.5241 9.94951 6.20957 numMergedOcc 0
51 mol 48 unq 7 iso 1 dist 7.99434 5.76698 7.78689 12.7252 6.5241 9.94951 9.72202 8.10774 5.56357 6.20957 numMergedOcc 0
52 mol 48 unq 8 iso 0 dist 7.49794 11.3706 7.70645 13.819 8.14245 5.43784 11.8742 6.36817 9.7018 6.29252 numMergedOcc 0
53 mol 48 unq 8 iso 1 dist 7.49794 11.3706 7.70645 11.8742 6.36817 9.7018 13.819 8.14245 5.43784 6.29252 numMergedOcc 0
54 mol 48 unq 9 iso 0 dist 7.49794 11.3706 7.70645 13.819 8.14245 5.43784 5.44298 8.0812 8.95384 10.8994 numMergedOcc 0
55 mol 48 unq 9 iso 1 dist 7.49794 11.3706 7.70645 5.44298 8.0812 8.95384 13.819 8.14245 5.43784 10.8994 numMergedOcc 0
56 mol 48 unq 10 iso 0 dist 7.49794 11.3706 7.70645 13.819 8.14245 5.43784 9.10301 4.17933 4.57947 4.73799 numMergedOcc 0
57 mol 48 unq 10 iso 1 dist 7.49794 11.3706 7.70645 9.10301 4.17933 4.57947 13.819 8.14245 5.43784 4.73799 numMergedOcc 0
58 mol 48 unq 11 iso 0 dist 7.49794 11.3706 7.70645 13.819 8.14245 5.43784 7.24268 5.54893 4.60843 7.19576 numMergedOcc 0
59 mol 48 unq 11 iso 1 dist 7.49794 11.3706 7.70645 7.24268 5.54893 4.60843 13.819 8.14245 5.43784 7.19576 numMergedOcc 0
60 mol 48 unq 9 iso 0 dist 7.49794 11.3706 7.70645 11.8742 6.36817 9.7018 5.44298 8.0812 8.95384 9.94041 numMergedOcc 0
61 mol 48 unq 9 iso 1 dist 7.49794 11.3706 7.70645 5.44298 8.0812 8.95384 11.8742 6.36817 9.7018 9.94041 numMergedOcc 0
62 mol 48 unq 10 iso 0 dist 7.49794 11.3706 7.70645 11.8742 6.36817 9.7018 9.10301 4.17933 4.57947 5.553 numMergedOcc 0
63 mol 48 unq 10 iso 1 dist 7.49794 11.3706 7.70645 9.10301 4.17933 4.57947 11.8742 6.36817 9.7018 5.553 numMergedOcc 0
64 mol 48 unq 11 iso 0 dist 7.49794 11.3706 7.70645 11.8742 6.36817 9.7018 7.24268 5.54893 4.60843 8.14415 numMergedOcc 0
65 mol 48 unq 11 iso 1 dist 7.49794 11.3706 7.70645 7.24268 5.54893 4.60843 11.8742 6.36817 9.7018 8.14415 numMergedOcc 0
66 mol 48 unq 10 iso 0 dist 7.49794 11.3706 7.70645 5.44298 8.0812 8.95384 9.10301 4.17933 4.57947 6.96103 numMergedOcc 0
67 mol 48 unq 10 iso 1 dist 7.49794 11.3706 7.70645 9.10301 4.17933 4.57947 5.44298 8.0812 8.95384 6.96103 numMergedOcc 0
68 mol 48 unq 11 iso 0 dist 7.49794 11.3706 7.70645 5.44298 8.0812 8.95384 7.24268 5.54893 4.60843 4.54874 numMergedOcc 0
69 mol 48 unq 11 iso 1 dist 7.49794 11.3706 7.70645 7.24268 5.54893 4.60843 5.44298 8.0812 8.95384 4.54874 numMergedOcc 0
70 mol 48 unq 11 iso 0 dist 7.49794 11.3706 7.70645 9.10301 4.17933 4.57947 7.24268 5.54893 4.60843 3.18526 numMergedOcc 0
71 mol 48 unq 11 iso 1 dist 7.49794 11.3706 7.70645 7.24268 5.54893 4.60843 9.10301 4.17933 4.57947 3.18526 numMergedOcc 0
72 mol 48 unq 12 iso 0 dist 8.10222 5.75684 7.70645 9.57893 8.14245 5.43784 12.6437 6.36817 9.7018 6.29252 numMergedOcc 0
73 mol 48 unq 12 iso 1 dist 8.10222 5.75684 7.70645 12.6437 6.36817 9.7018 9.57893 8.14245 5.43784 6.29252 numMergedOcc 0
74 mol 48 unq 13 iso 0 dist 8.10222 5.75684 7.70645 9.57893 8.14245 5.43784 12.0687 8.0812 8.95384 10.8994 numMergedOcc 0
75 mol 48 unq 13 iso 1 dist 8.10222 5.75684 7.70645 12.0687 8.0812 8.95384 9.57893 8.14245 5.43784 10.8994 numMergedOcc 0
76 mol 48 unq 14 iso 0 dist 8.10222 5.75684 7.70645 9.57893 8.14245 5.43784 7.88988 4.17933 4.57947 4.73799 numMergedOcc 0
77 mol 48 unq 14 iso 1 dist 8.10222 5.75684 7.70645 7.88988 4.17933 4.57947 9.57893 8.14245 5.43784 4.73799 numMergedOcc 0
78 mol 48 unq 15 iso 0 dist 8.10222 5.75684 7.70645 9.57893 8.14245 5.43784 8.00934 5.54893 4.60843 7.19576 numMergedOcc 0
79 mol 48 unq 15 iso 1 dist 8.10222 5.75684 7.70645 8.00934 5.54893 4.60843 9.57893 8.14245 5.43784 7.19576 numMergedOcc 0
80 mol 48 unq 13 iso 0 dist 8.10222 5.75684 7.70645 12.6437 6.36817 9.7018 12.0687 8.0812 8.95384 9.94041 numMergedOcc 0
81 mol 48 unq 13 iso 1 dist 8.10222 5.75684 7.70645 12.0687 8.0812 8.95384 12.6437 6.36817 9.7018 9.94041 numMergedOcc 0
82 mol 48 unq 14 iso 0 dist 8.10222 5.75684 7.70645 12.6437 6.36817 9.7018 7.88988 4.17933 4.57947 5.553 numMergedOcc 0
83 mol 48 unq 14 iso 1 dist 8.10222 5.75684 7.70645 7.88988 4.17933 4.57947 12.6437 6.36817 9.7018 5.553 numMergedOcc 0
84 mol 48 unq 15 iso 0 dist 8.10222 5.75684 7.70645 12.6437 6.36817 9.7018 8.00934 5.54893 4.60843 8.14415 numMergedOcc 0
85 mol 48 unq 15 iso 1 dist 8.10222 5.75684 7.70645 8.00934 5.54893 4.60843 12.6437 6.36817 9.7018 8.14415 numMergedOcc 0
86 mol 48 unq 14 iso 0 dist 8.10222 5.75684 7.70645 12.0687 8.0812 8.95384 7.88988 4.17933 4.57947 6.96103 numMergedOcc 0
87 mol 48 unq 14 iso 1 dist 8.10222 5.75684 7.70645 7.88988 4.17933 4.57947 12.0687 8.0812 8.95384 6.96103 numMergedOcc 0
88 mol 48 unq 15 iso 0 dist 8.10222 5.75684 7.70645 12.0687 8.0812 8.95384 8.00934 5.54893 4.60843 4.54874 numMergedOcc 0
89 mol 48 unq 15 iso 1 dist 8.10222 5.75684 7.70645 8.00934 5.54893 4.60843 12.0687 8.0812 8.95384 4.54874 numMergedOcc 0
90 mol 48 unq 15 iso 0 dist 8.10222 5.75684 7.70645 7.88988 4.17933 4.57947 8.00934 5.54893 4.60843 3.18526 numMergedOcc 0
91 mol 48 unq 15 iso 1 dist 8.10222 5.75684 7.70645 8.00934 5.54893 4.60843 7.88988 4.17933 4.57947 3.18526 numMergedOcc 0
92 mol 63 unq 0 iso 0 dist 6.89855 5.74753 8.78414 5.04771 8.14512 4.73277 9.54378 9.13228 10.1907 13.0286 numMergedOcc 0
93 mol 63 unq 0 iso 1 dist 6.89855 5.74753 8.78414 9.54378 9.13228 10.1907 5.04771 8.14512 4.73277 13.0286 numMergedOcc 0
94 mol 63 unq 1 iso 0 dist 7.85738 5.82517 8.78414 9.28052 8.14512 4.73277 4.44607 9.13228 10.1907 13.0286 numMergedOcc 0
95 mol 63 unq 1 iso 1 dist 7.85738 5.82517 8.78414 4.44607 9.13228 10.1907 9.28052 8.14512 4.73277 13.0286 numMergedOcc 0
96 mol 76 unq 0 iso 0 dist 5.91098 13.363 9.57759 11.6853 7.66068 9.50354 15.0489 9.5043 12.0331 6.98219 numMergedOcc 0
97 mol 76 unq 0 iso 1 dist 5.91098 13.363 9.57759 15.0489 9.5043 12.0331 11.6853 7.66068 9.50354 6.98219 numMergedOcc 0
98 mol 76 unq 1 iso 0 dist 5.91098 13.363 9.57759 11.6853 7.66068 9.50354 14.2393 8.34132 9.2434 8.74837 numMergedOcc 0
99 mol 76 unq 1 iso 1 dist 5.91098 13.363 9.57759 14.2393 8.34132 9.2434 11.6853 7.66068 9.50354 8.74837 numMergedOcc 0
100 mol 76 unq 1 iso 0 dist 5.91098 13.363 9.57759 15.0489 9.5043 12.0331 14.2393 8.34132 9.2434 4.82479 numMergedOcc 0
101 mol 76 unq 1 iso 1 dist 5.91098 13.363 9.57759 14.2393 8.34132 9.2434 15.0489 9.5043 12.0331 4.82479 numMergedOcc 0
102 mol 76 unq 2 iso 0 dist 4.86523 7.37421 9.57759 4.94673 7.66068 9.50354 5.78236 9.5043 12.0331 6.98219 numMergedOcc 0
103 mol 76 unq 2 iso 1 dist 4.86523 7.37421 9.57759 5.78236 9.5043 12.0331 4.94673 7.66068 9.50354 6.98219 numMergedOcc 0
104 mol 76 unq 3 iso 0 dist 4.86523 7.37421 9.57759 4.94673 7.66068 9.50354 4.73151 8.34132 9.2434 8.74837 numMergedOcc 0
105 mol 76 unq 3 iso 1 dist 4.86523 7.37421 9.57759 4.73151 8.34132 9.2434 4.94673 7.66068 9.50354 8.74837 numMergedOcc 0
106 mol 76 unq 3 iso 0 dist 4.86523 7.37421 9.57759 5.78236 9.5043 12.0331 4.73151 8.34132 9.2434 4.82479 numMergedOcc 0
107 mol 76 unq 3 iso 1 dist 4.86523 7.37421 9.57759 4.73151 8.34132 9.2434 5.78236 9.5043 12.0331 4.82479 numMergedOcc 0
108 mol 78 unq 0 iso 0 dist 6.11101 7.35151 9.38837 5.72585 9.07629 4.83106 7.38398 8.61143 4.315 8.09729 numMergedOcc 0
109 mol 78 unq 0 iso 1 dist 6.11101 7.35151 9.38837 7.38398 8.61143 4.315 5.72585 9.07629 4.83106 8.09729 numMergedOcc 0
110 mol 78 unq 1 iso 0 dist 6.11101 4.76634 9.80913 5.72585 9.07629 9.40741 7.38398 8.61143 9.00868 8.09729 numMergedOcc 0
111 mol 78 unq 1 iso 1 dist 6.11101 4.76634 9.80913 7.38398 8.61143 9.00868 5.72585 9.07629 9.40741 8.09729 numMergedOcc 0
112 mol 83 unq 0 iso 0 dist 7.69755 4.93836 5.35861 4.12785 7.50925 3.62753 6.83349 6.96722 3.65203 6.91034 numMergedOcc 0
113 mol 83 unq 0 iso 1 dist 7.69755 4.93836 5.35861 6.83349 6.96722 3.65203 4.12785 7.50925 3.62753 6.91034 numMergedOcc 0
114 mol 83 unq 1 iso 0 dist 9.64197 8.82563 5.35861 9.58199 7.50925 3.62753 8.6522 6.96722 3.65203 6.91034 numMergedOcc 0
115 mol 83 unq 1 iso 1 dist 9.64197 8.82563 5.35861 8.6522 6.96722 3.65203 9.58199 7.50925 3.62753 6.91034 numMergedOcc 0
116 mol 85 unq 0 iso 0 dist 8.66427 12.4236 5.37869 5.26904 7.07839 10.0372 11.9441 9.09711 11.8779 7.6242 numMergedOcc 0
117 mol 85 unq 0 iso 1 dist 8.66427 12.4236 5.37869 11.9441 9.09711 11.8779 5.26904 7.07839 10.0372 7.6242 numMergedOcc 0
118 mol 85 unq 1 iso 0 dist 8.66427 12.4236 5.37869 5.26904 7.07839 10.0372 13.8217 7.04244 3.65186 10.1082 numMergedOcc 0
119 mol 85 unq 1 iso 1 dist 8.66427 12.4236 5.37869 13.8217 7.04244 3.65186 5.26904 7.07839 10.0372 10.1082 numMergedOcc 0
120 mol 85 unq 2 iso 0 dist 8.66427 12.4236 5.37869 5.26904 7.07839 10.0372 6.77316 7.91193 11.7094 3.24037 numMergedOcc 0
121 mol 85 unq 2 iso 1 dist 8.66427 12.4236 5.37869 6.77316 7.91193 11.7094 5.26904 7.07839 10.0372 3.24037 numMergedOcc 0
122 mol 85 unq 3 iso 0 dist 8.66427 12.4236 5.37869 5.26904 7.07839 10.0372 9.54731 9.63449 12.2971 12.8332 numMergedOcc 0
123 mol 85 unq 3 iso 1 dist 8.66427 12.4236 5.37869 9.54731 9.63449 12.2971 5.26904 7.07839 10.0372 12.8332 numMergedOcc 0
124 mol 85 unq 1 iso 0 dist 8.66427 12.4236 5.37869 11.9441 9.09711 11.8779 13.8217 7.04244 3.65186 10.1757 numMergedOcc 0
125 mol 85 unq 1 iso 1 dist 8.66427 12.4236 5.37869 13.8217 7.04244 3.65186 11.9441 9.09711 11.8779 10.1757 numMergedOcc 0
126 mol 85 unq 2 iso 0 dist 8.66427 12.4236 5.37869 11.9441 9.09711 11.8779 6.77316 7.91193 11.7094 5.44737 numMergedOcc 0
127 mol 85 unq 2 iso 1 dist 8.66427 12.4236 5.37869 6.77316 7.91193 11.7094 11.9441 9.09711 11.8779 5.44737 numMergedOcc 0
128 mol 85 unq 3 iso 0 dist 8.66427 12.4236 5.37869 11.9441 9.09711 11.8779 9.54731 9.63449 12.2971 17.7038 numMergedOcc 0
129 mol 85 unq 3 iso 1 dist 8.66427 12.4236 5.37869 9.54731 9.63449 12.2971 11.9441 9.09711 11.8779 17.7038 numMergedOcc 0
130 mol 85 unq 2 iso 0 dist 8.66427 12.4236 5.37869 13.8217 7.04244 3.65186 6.77316 7.91193 11.7094 11.3346 numMergedOcc 0
131 mol 85 unq 2 iso 1 dist 8.66427 12.4236 5.37869 6.77316 7.91193 11.7094 13.8217 7.04244 3.65186 11.3346 numMergedOcc 0
132 mol 85 unq 3 iso 0 dist 8.66427 12.4236 5.37869 13.8217 7.04244 3.65186 9.54731 9.63449 12.2971 15.509 numMergedOcc 0
133 mol 85 unq 3 iso 1 dist 8.66427 12.4236 5.37869 9.54731 9.63449 12.2971 13.8217 7.04244 3.65186 15.509 numMergedOcc 0
134 mol 85 unq 3 iso 0 dist 8.66427 12.4236 5.37869 6.77316 7.91193 11.7094 9.54731 9.63449 12.2971 14.2704 numMergedOcc 0
135 mol 85 unq 3 iso 1 dist 8.66427 12.4236 5.37869 9.54731 9.63449 12.2971 6.77316 7.91193 11.7094 14.2704 numMergedOcc 0
136 mol 85 unq 4 iso 0 dist 8.66427 9.61831 4.05415 5.26904 7.07839 8.78995 11.9441 9.09711 12.4835 7.6242 numMergedOcc 0
137 mol 85 unq 4 iso 1 dist 8.66427 9.61831 4.05415 11.9441 9.09711 12.4835 5.26904 7.07839 8.78995 7.6242 numMergedOcc 0
138 mol 85 unq 5 iso 0 dist 8.66427 9.61831 4.05415 5.26904 7.07839 8.78995 13.8217 7.04244 7.00044 10.1082 numMergedOcc 0
139 mol 85 unq 5 iso 1 dist 8.66427 9.61831 4.05415 13.8217 7.04244 7.00044 5.26904 7.07839 8.78995 10.1082 numMergedOcc 0
140 mol 85 unq 6 iso 0 dist 8.66427 9.61831 4.05415 5.26904 7.07839 8.78995 6.77316 7.91193 10.7591 3.24037 numMergedOcc 0
141 mol 85 unq 6 iso 1 dist 8.66427 9.61831 4.05415 6.77316 7.91193 10.7591 5.26904 7.07839 8.78995 3.24037 numMergedOcc 0
142 mol 85 unq 7 iso 0 dist 8.66427 9.61831 4.05415 5.26904 7.07839 8.78995 9.54731 9.63449 8.64367 12.8332 numMergedOcc 0
143 mol 85 unq 7 iso 1 dist 8.66427 9.61831 4.05415 9.54731 9.63449 8.64367 5.26904 7.07839 8.78995 12.8332 numMergedOcc 0
144 mol 85 unq 5 iso 0 dist 8.66427 9.61831 4.05415 11.9441 9.09711 12.4835 13.8217 7.04244 7.00044 10.1757 numMergedOcc 0
145 mol 85 unq 5 iso 1 dist 8.66427 9.61831 4.05415 13.8217 7.04244 7.00044 11.9441 9.09711 12.4835 10.1757 numMergedOcc 0
146 mol 85 unq 6 iso 0 dist 8.66427 9.61831 4.05415 11.9441 9.09711 12.4835 6.77316 7.91193 10.7591 5.44737 numMergedOcc 0
147 mol 85 unq 6 iso 1 dist 8.66427 9.61831 4.05415 6.77316 7.91193 10.7591 11.9441 9.09711 12.4835 5.44737 numMergedOcc 0
148 mol 85 unq 7 iso 0 dist 8.66427 9.61831 4.05415 11.9441 9.09711 12.4835 9.54731 9.63449 8.64367 17.7038 numMergedOcc 0
149 mol 85 unq 7 iso 1 dist 8.66427 9.61831 4.05415 9.54731 9.63449 8.64367 11.9441 9.09711 12.4835 17.7038 numMergedOcc 0
150 mol 85 unq 6 iso 0 dist 8.66427 9.61831 4.05415 13.8217 7.04244 7.00044 6.77316 7.91193 10.7591 11.3346 numMergedOcc 0
151 mol 85 unq 6 iso 1 dist 8.66427 9.61831 4.05415 6.77316 7.91193 10.7591 13.8217 7.04244 7.00044 11.3346 numMergedOcc 0
152 mol 85 unq 7 iso 0 dist 8.66427 9.61831 4.05415 13.8217 7.04244 7.00044 9.54731 9.63449 8.64367 15.509 numMergedOcc 0
153 mol 85 unq 7 iso 1 dist 8.66427 9.61831 4.05415 9.54731 9.63449 8.64367 13.8217 7.04244 7.00044 15.509 numMergedOcc 0
154 mol 85 unq 7 iso 0 dist 8.66427 9.61831 4.05415 6.77316 7.91193 10.7591 9.54731 9.63449 8.64367 14.2704 numMergedOcc 0
155 mol 85 unq 7 iso 1 dist 8.66427 9.61831 4.05415 9.54731 9.63449 8.64367 6.77316 7.91193 10.7591 14.2704 numMergedOcc 0
156 mol 85 unq 8 iso 0 dist 8.66427 11.3963 9.97944 5.26904 7.07839 14.2664 11.9441 9.09711 17.9023 7.6242 numMergedOcc 0
157 mol 85 unq 8 iso 1 dist 8.66427 11.3963 9.97944 11.9441 9.09711 17.9023 5.26904 7.07839 14.2664 7.6242 numMergedOcc 0
158 mol 85 unq 9 iso 0 dist 8.66427 11.3963 9.97944 5.26904 7.07839 14.2664 13.8217 7.04244 16.1804 10.1082 numMergedOcc 0
159 mol 85 unq 9 iso 1 dist 8.66427 11.3963 9.97944 13.8217 7.04244 16.1804 5.26904 7.07839 14.2664 10.1082 numMergedOcc 0
160 mol 85 unq 10 iso 0 dist 8.66427 11.3963 9.97944 5.26904 7.07839 14.2664 6.77316 7.91193 15.1209 3.24037 numMergedOcc 0
161 mol 85 unq 10 iso 1 dist 8.66427 11.3963 9.97944 6.77316 7.91193 15.1209 5.26904 7.07839 14.2664 3.24037 numMergedOcc 0
162 mol 85 unq 11 iso 0 dist 8.66427 11.3963 9.97944 5.26904 7.07839 14.2664 9.54731 9.63449 3.21259 12.8332 numMergedOcc 0
163 mol 85 unq 11 iso 1 dist 8.66427 11.3963 9.97944 9.54731 9.63449 3.21259 5.26904 7.07839 14.2664 12.8332 numMergedOcc 0
164 mol 85 unq 9 iso 0 dist 8.66427 11.3963 9.97944 11.9441 9.09711 17.9023 13.8217 7.04244 16.1804 10.1757 numMergedOcc 0
165 mol 85 unq 9 iso 1 dist 8.66427 11.3963 9.97944 13.8217 7.04244 16.1804 11.9441 9.09711 17.9023 10.1757 numMergedOcc 0
166 mol 85 unq 10 iso 0 dist 8.66427 11.3963 9.97944 11.9441 9.09711 17.9023 6.77316 7.91193 15.1209 5.44737 numMergedOcc 0
167 mol 85 unq 10 iso 1 dist 8.66427 11.3963 9.97944 6.77316 7.91193 15.1209 11.9441 9.09711 17.9023 5.44737 numMergedOcc 0
168 mol 85 unq 11 iso 0 dist 8.66427 11.3963 9.97944 11.9441 9.09711 17.9023 9.54731 9.63449 3.21259 17.7038 numMergedOcc 0
169 mol 85 unq 11 iso 1 dist 8.66427 11.3963 9.97944 9.54731 9.63449 3.21259 11.9441 9.09711 17.9023 17.7038 numMergedOcc 0
170 mol 85 unq 10 iso 0 dist 8.66427 11.3963 9.97944 13.8217 7.04244 16.1804 6.77316 7.91193 15.1209 11.3346 numMergedOcc 0
171 mol 85 unq 10 iso 1 dist 8.66427 11.3963 9.97944 6.77316 7.91193 15.1209 13.8217 7.04244 16.1804 11.3346 numMergedOcc 0
172 mol 85 unq 11 iso 0 dist 8.66427 11.3963 9.97944 13.8217 7.04244 16.1804 9.54731 9.63449 3.21259 15.509 numMergedOcc 0
173 mol 85 unq 11 iso 1 dist 8.66427 11.3963 9.97944 9.54731 9.63449 3.21259 13.8217 7.04244 16.1804 15.509 numMergedOcc 0
174 mol 85 unq 11 iso 0 dist 8.66427 11.3963 9.97944 6.77316 7.91193 15.1209 9.54731 9.63449 3.21259 14.2704 numMergedOcc 0
175 mol 85 unq 11 iso 1 dist 8.66427 11.3963 9.97944 9.54731 9.63449 3.21259 6.77316 7.91193 15.1209 14.2704 numMergedOcc 0
176 mol 85 unq 12 iso 0 dist 7.51319 8.08787 4.29937 6.90443 6.67137 3.65186 17.0873 9.78707 12.2971 15.509 numMergedOcc 0
177 mol 85 unq 12 iso 1 dist 7.51319 8.08787 4.29937 17.0873 9.78707 12.2971 6.90443 6.67137 3.65186 15.509 numMergedOcc 0
178 mol 85 unq 13 iso 0 dist 7.51319 10.4844 3.65628 6.90443 6.67137 7.00044 17.0873 9.78707 8.64367 15.509 numMergedOcc 0
179 mol 85 unq 13 iso 1 dist 7.51319 10.4844 3.65628 17.0873 9.78707 8.64367 6.90443 6.67137 7.00044 15.509 numMergedOcc 0
180 mol 85 unq 14 iso 0 dist 7.51319 16.4231 9.77774 6.90443 6.67137 16.1804 17.0873 9.78707 3.21259 15.509 numMergedOcc 0
181 mol 85 unq 14 iso 1 dist 7.51319 16.4231 9.77774 17.0873 9.78707 3.21259 6.90443 6.67137 16.1804 15.509 numMergedOcc 0
182 mol 85 unq 15 iso 0 dist 8.49887 8.08787 5.37869 13.5026 7.07839 10.0372 10.1386 9.09711 11.8779 7.6242 numMergedOcc 0
183 mol 85 unq 15 iso 1 dist 8.49887 8.08787 5.37869 10.1386 9.09711 11.8779 13.5026 7.07839 10.0372 7.6242 numMergedOcc 0
184 mol 85 unq 16 iso 0 dist 8.49887 8.08787 5.37869 13.5026 7.07839 10.0372 6.90443 7.04244 3.65186 10.1082 numMergedOcc 0
185 mol 85 unq 16 iso 1 dist 8.49887 8.08787 5.37869 6.90443 7.04244 3.65186 13.5026 7.07839 10.0372 10.1082 numMergedOcc 0
186 mol 85 unq 17 iso 0 dist 8.49887 8.08787 5.37869 13.5026 7.07839 10.0372 13.1772 7.91193 11.7094 3.24037 numMergedOcc 0
187 mol 85 unq 17 iso 1 dist 8.49887 8.08787 5.37869 13.1772 7.91193 11.7094 13.5026 7.07839 10.0372 3.24037 numMergedOcc 0
188 mol 85 unq 18 iso 0 dist 8.49887 8.08787 5.37869 13.5026 7.07839 10.0372 17.0873 9.63449 12.2971 12.8332 numMergedOcc 0
189 mol 85 unq 18 iso 1 dist 8.49887 8.08787 5.37869 17.0873 9.63449 12.2971 13.5026 7.07839 10.0372 12.8332 numMergedOcc 0
190 mol 85 unq 16 iso 0 dist 8.49887 8.08787 5.37869 10.1386 9.09711 11.8779 6.90443 7.04244 3.65186 10.1757 numMergedOcc 0
191 mol 85 unq 16 iso 1 dist 8.49887 8.08787 5.37869 6.90443 7.04244 3.65186 10.1386 9.09711 11.8779 10.1757 numMergedOcc 0
192 mol 85 unq 17 iso 0 dist 8.49887 8.08787 5.37869 10.1386 9.09711 11.8779 13.1772 7.91193 11.7094 5.44737 numMergedOcc 0
193 mol 85 unq 17 iso 1 dist 8.49887 8.08787 5.37869 13.1772 7.91193 11.7094 10.1386 9.09711 11.8779 5.44737 numMergedOcc 0
194 mol 85 unq 18 iso 0 dist 8.49887 8.08787 5.37869 10.1386 9.09711 11.8779 17.0873 9.63449 12.2971 17.7038 numMergedOcc 0
195 mol 85 unq 18 iso 1 dist 8.49887 8.08787 5.37869 17.0873 9.63449 12.2971 10.1386 9.09711 11.8779 17.7038 numMergedOcc 0
196 mol 85 unq 17 iso 0 dist 8.49887 8.08787 5.37869 6.90443 7.04244 3.65186 13.1772 7.91193 11.7094 11.3346 numMergedOcc 0
197 mol 85 unq 17 iso 1 dist 8.49887 8.08787 5.37869 13.1772 7.91193 11.7094 6.90443 7.04244 3.65186 11.3346 numMergedOcc 0
198 mol 85 unq 18 iso 0 dist 8.49887 8.08787 5.37869 6.90443 7.04244 3.65186 17.0873 9.63449 12.2971 15.509 numMergedOcc 0
199 mol 85 unq 18 iso 1 dist 8.49887 8.08787 5.37869 17.0873 9.63449 12.2971 6.90443 7.04244 3.65186 15.509 numMergedOcc 0
200 mol 85 unq 18 iso 0 dist 8.49887 8.08787 5.37869 13.1772 7.91193 11.7094 17.0873 9.63449 12.2971 14.2704 numMergedOcc 0
201 mol 85 unq 18 iso 1 dist 8.49887 8.08787 5.37869 17.0873 9.63449 12.2971 13.1772 7.91193 11.7094 14.2704 numMergedOcc 0
202 mol 85 unq 19 iso 0 dist 8.49887 10.4844 4.05415 13.5026 7.07839 8.78995 10.1386 9.09711 12.4835 7.6242 numMergedOcc 0
203 mol 85 unq 19 iso 1 dist 8.49887 10.4844 4.05415 10.1386 9.09711 12.4835 13.5026 7.07839 8.78995 7.6242 numMergedOcc 0
204 mol 85 unq 20 iso 0 dist 8.49887 10.4844 4.05415 13.5026 7.07839 8.78995 6.90443 7.04244 7.00044 10.1082 numMergedOcc 0
205 mol 85 unq 20 iso 1 dist 8.49887 10.4844 4.05415 6.90443 7.04244 7.00044 13.5026 7.07839 8.78995 10.1082 numMergedOcc 0
206 mol 85 unq 21 iso 0 dist 8.49887 10.4844 4.05415 13.5026 7.07839 8.78995 13.1772 7.91193 10.7591 3.24037 numMergedOcc 0
207 mol 85 unq 21 iso 1 dist 8.49887 10.4844 4.05415 13.1772 7.91193 10.7591 13.5026 7.07839 8.78995 3.24037 numMergedOcc 0
208 mol 85 unq 22 iso 0 dist 8.49887 10.4844 4.05415 13.5026 7.07839 8.78995 17.0873 9.63449 8.64367 12.8332 numMergedOcc 0
209 mol 85 unq 22 iso 1 dist 8.49887 10.4844 4.05415 17.0873 9.63449 8.64367 13.5026 7.07839 8.78995 12.8332 numMergedOcc 0
210 mol 85 unq 20 iso 0 dist 8.49887 10.4844 4.05415 10.1386 9.09711 12.4835 6.90443 7.04244 7.00044 10.1757 numMergedOcc 0
211 mol 85 unq 20 iso 1 dist 8.49887 10.4844 4.05415 6.90443 7.04244 7.00044 10.1386 9.09711 12.4835 10.1757 numMergedOcc 0
212 mol 85 unq 21 iso 0 dist 8.49887 10.4844 4.05415 10.1386 9.09711 12.4835 13.1772 7.91193 10.7591 5.44737 numMergedOcc 0
213 mol 85 unq 21 iso 1 dist 8.49887 10.4844 4.05415 13.1772 7.91193 10.7591 10.1386 9.09711 12.4835 5.44737 numMergedOcc 0
214 mol 85 unq 22 iso 0 dist 8.49887 10.4844 4.05415 10.1386 9.09711 12.4835 17.0873 9.63449 8.64367 17.7038 numMergedOcc 0
215 mol 85 unq 22 iso 1 dist 8.49887 10.4844 4.05415 17.0873 9.63449 8.64367 10.1386 9.09711 12.4835 17.7038 numMergedOcc 0
216 mol 85 unq 21 iso 0 dist 8.49887 10.4844 4.05415 6.90443 7.04244 7.00044 13.1772 7.91193 10.7591 11.3346 numMergedOcc 0
217 mol 85 unq 21 iso 1 dist 8.49887 10.4844 4.05415 13.1772 7.91193 10.7591 6.90443 7.04244 7.00044 11.3346 numMergedOcc 0
218 mol 85 unq 22 iso 0 dist 8.49887 10.4844 4.05415 6.90443 7.04244 7.00044 17.0873 9.63449 8.64367 15.509 numMergedOcc 0
219 mol 85 unq 22 iso 1 dist 8.49887 10.4844 4.05415 17.0873 9.63449 8.64367 6.90443 7.04244 7.00044 15.509 numMergedOcc 0
220 mol 85 unq 22 iso 0 dist 8.49887 10.4844 4.05415 13.1772 7.91193 10.7591 17.0873 9.63449 8.64367 14.2704 numMergedOcc 0
221 mol 85 unq 22 iso 1 dist 8.49887 10.4844 4.05415 17.0873 9.63449 8.64367 13.1772 7.91193 10.7591 14.2704 numMergedOcc 0
222 mol 85 unq 23 iso 0 dist 8.49887 16.4231 9.97944 13.5026 7.07839 14.2664 10.1386 9.09711 17.9023 7.6242 numMergedOcc 0
223 mol 85 unq 23 iso 1 dist 8.49887 16.4231 9.97944 10.1386 9.09711 17.9023 13.5026 7.07839 14.2664 7.6242 numMergedOcc 0
224 mol 85 unq 24 iso 0 dist 8.49887 16.4231 9.97944 13.5026 7.07839 14.2664 6.90443 7.04244 16.1804 10.1082 numMergedOcc 0
225 mol 85 unq 24 iso 1 dist 8.49887 16.4231 9.97944 6.90443 7.04244 16.1804 13.5026 7.07839 14.2664 10.1082 numMergedOcc 0
226 mol 85 unq 25 iso 0 dist 8.49887 16.4231 9.97944 13.5026 7.07839 14.2664 13.1772 7.91193 15.1209 3.24037 numMergedOcc 0
227 mol 85 unq 25 iso 1 dist 8.49887 16.4231 9.97944 13.1772 7.91193 15.1209 13.5026 7.07839 14.2664 3.24037 numMergedOcc 0
228 mol 85 unq 26 iso 0 dist 8.49887 16.4231 9.97944 13.5026 7.07839 14.2664 17.0873 9.63449 3.21259 12.8332 numMergedOcc 0
229 mol 85 unq 26 iso 1 dist 8.49887 16.4231 9.97944 17.0873 9.63449 3.21259 13.5026 7.07839 14.2664 12.8332 numMergedOcc 0
230 mol 85 unq 24 iso 0 dist 8.49887 16.4231 9.97944 10.1386 9.09711 17.9023 6.90443 7.04244 16.1804 10.1757 numMergedOcc 0
231 mol 85 unq 24 iso 1 dist 8.49887 16.4231 9.97944 6.90443 7.04244 16.1804 10.1386 9.09711 17.9023 10.1757 numMergedOcc 0
232 mol 85 unq 25 iso 0 dist 8.49887 16.4231 9.97944 10.1386 9.09711 17.9023 13.1772 7.91193 15.1209 5.44737 numMergedOcc 0
233 mol 85 unq 25 iso 1 dist 8.49887 16.4231 9.97944 13.1772 7.91193 15.1209 10.1386 9.09711 17.9023 5.44737 numMergedOcc 0
234 mol 85 unq 26 iso 0 dist 8.49887 16.4231 9.97944 10.1386 9.09711 17.9023 17.0873 9.63449 3.21259 17.7038 numMergedOcc 0
235 mol 85 unq 26 iso 1 dist 8.49887 16.4231 9.97944 17.0873 9.63449 3.21259 10.1386 9.09711 17.9023 17.7038 numMergedOcc 0
236 mol 85 unq 25 iso 0 dist 8.49887 16.4231 9.97944 6.90443 7.04244 16.1804 13.1772 7.91193 15.1209 11.3346 numMergedOcc 0
237 mol 85 unq 25 iso 1 dist 8.49887 16.4231 9.97944 13.1772 7.91193 15.1209 6.90443 7.04244 16.1804 11.3346 numMergedOcc 0
238 mol 85 unq 26 iso 0 dist 8.49887 16.4231 9.97944 6.90443 7.04244 16.1804 17.0873 9.63449 3.21259 15.509 numMergedOcc 0
239 mol 85 unq 26 iso 1 dist 8.49887 16.4231 9.97944 17.0873 9.63449 3.21259 6.90443 7.04244 16.1804 15.509 numMergedOcc 0
240 mol 85 unq 26 iso 0 dist 8.49887 16.4231 9.97944 13.1772 7.91193 15.1209 17.0873 9.63449 3.21259 14.2704 numMergedOcc 0
241 mol 85 unq 26 iso 1 dist 8.49887 16.4231 9.97944 17.0873 9.63449 3.21259 13.1772 7.91193 15.1209 14.2704 numMergedOcc 0
242 mol 85 unq 27 iso 0 dist 9.43839 11.053 4.29937 14.6513 6.67137 3.65186 4.43737 9.78707 12.2971 15.509 numMergedOcc 0
243 mol 85 unq 27 iso 1 dist 9.43839 11.053 4.29937 4.43737 9.78707 12.2971 14.6513 6.67137 3.65186 15.509 numMergedOcc 0
244 mol 85 unq 28 iso 0 dist 9.43839 7.97629 3.65628 14.6513 6.67137 7.00044 4.43737 9.78707 8.64367 15.509 numMergedOcc 0
245 mol 85 unq 28 iso 1 dist 9.43839 7.97629 3.65628 4.43737 9.78707 8.64367 14.6513 6.67137 7.00044 15.509 numMergedOcc 0
246 mol 85 unq 29 iso 0 dist 9.43839 5.46713 9.77774 14.6513 6.67137 16.1804 4.43737 9.78707 3.21259 15.509 numMergedOcc 0
247 mol 85 unq 29 iso 1 dist 9.43839 5.46713 9.77774 4.43737 9.78707 3.21259 14.6513 6.67137 16.1804 15.509 numMergedOcc 0
248 mol 107 unq 0 iso 0 dist 7.2168 9.89064 5.31375 8.41816 8.88124 9.65216 15.3177 8.19484 8.32169 13.5807 numMergedOcc 0
249 mol 107 unq 0 iso 1 dist 7.2168 9.89064 5.31375 15.3177 8.19484 8.32169 8.41816 8.88124 9.65216 13.5807 numMergedOcc 0
250 mol 107 unq 1 iso 0 dist 7.2168 13.076 6.49371 8.41816 8.88124 10.4294 15.3177 8.19484 3.40943 13.5807 numMergedOcc 0
251 mol 107 unq 1 iso 1 dist 7.2168 13.076 6.49371 15.3177 8.19484 3.40943 8.41816 8.88124 10.4294 13.5807 numMergedOcc 0
252 mol 186 unq 0 iso 0 dist 4.79423 9.5548 8.92135 5.86994 7.25595 14.4913 8.74892 9.94825 5.43612 12.8007 numMergedOcc 0
253 mol 186 unq 0 iso 1 dist 4.79423 9.5548 8.92135 8.74892 9.94825 5.43612 5.86994 7.25595 14.4913 12.8007 numMergedOcc 0
254 mol 194 unq 0 iso 0 dist 9.81055 5.39223 5.89939 11.7008 4.68722 9.23342 14.7138 5.18325 10.3782 5.61057 numMergedOcc 0
255 mol 194 unq 0 iso 1 dist 9.81055 5.39223 5.89939 14.7138 5.18325 10.3782 11.7008 4.68722 9.23342 5.61057 numMergedOcc 0
256 mol 194 unq 1 iso 0 dist 9.81055 7.15294 8.18853 11.7008 4.68722 11.7699 14.7138 5.18325 13.0759 5.61057 numMergedOcc 0
257 mol 194 unq 1 iso 1 dist 9.81055 7.15294 8.18853 14.7138 5.18325 13.0759 11.7008 4.68722 11.7699 5.61057 numMergedOcc 0
258 mol 204 unq 0 iso 0 dist 8.77524 5.9943 7.33774 10.6524 8.32259 4.7839 9.88337 9.93489 4.05102 2.95898 numMergedOcc 0
259 mol 204 unq 0 iso 1 dist 8.77524 5.9943 7.33774 9.88337 9.93489 4.05102 10.6524 8.32259 4.7839 2.95898 numMergedOcc 0
260 mol 204 unq 1 iso 0 dist 9.26192 9.9686 7.98864 13.8736 9.93489 5.80328 6.40044 7.64057 3.68217 8.59834 numMergedOcc 0
261 mol 204 unq 1 iso 1 dist 9.26192 9.9686 7.98864 6.40044 7.64057 3.68217 13.8736 9.93489 5.80328 8.59834 numMergedOcc 0
262 mol 254 unq 0 iso 0 dist 9.84028 8.2786 5.6417 11.4342 7.85841 8.8967 11.2466 9.20109 10.929 3.15539 numMergedOcc 0
263 mol 254 unq 0 iso 1 dist 9.84028 8.2786 5.6417 11.2466 9.20109 10.929 11.4342 7.85841 8.8967 3.15539 numMergedOcc 0
264 mol 254 unq 1 iso 0 dist 9.84028 5.20737 7.42831 11.4342 7.85841 9.42679 11.2466 9.20109 10.706 3.15539 numMergedOcc 0
265 mol 254 unq 1 iso 1 dist 9.84028 5.20737 7.42831 11.2466 9.20109 10.706 11.4342 7.85841 9.42679 3.15539 numMergedOcc 0
266 mol 266 unq 0 iso 0 dist 6.48382 7.90149 8.20376 5.79323 6.96692 3.68488 7.52317 8.25286 3.14784 5.76129 numMergedOcc 0
267 mol 266 unq 0 iso 1 dist 6.48382 7.90149 8.20376 7.52317 8.25286 3.14784 5.79323 6.96692 3.68488 5.76129 numMergedOcc 0
268 mol 266 unq 1 iso 0 dist 6.48382 7.90149 8.20376 5.79323 6.96692 3.68488 9.52953 9.9965 5.95721 8.75066 numMergedOcc 0
269 mol 266 unq 1 iso 1 dist 6.48382 7.90149 8.20376 9.52953 9.9965 5.95721 5.79323 6.96692 3.68488 8.75066 numMergedOcc 0
270 mol 266 unq 1 iso 0 dist 6.48382 7.90149 8.20376 7.52317 8.25286 3.14784 9.52953 9.9965 5.95721 3.00605 numMergedOcc 0
271 mol 266 unq 1 iso 1 dist 6.48382 7.90149 8.20376 9.52953 9.9965 5.95721 7.52317 8.25286 3.14784 3.00605 numMergedOcc 0
