0 mol 93 unq 0 iso 0 dist 9.81831 6.30447 9.12858 4.4022 7.62611 8.96224 16.1023 7.8435 12.4934 14.9656 numMergedOcc 0
1 mol 93 unq 0 iso 1 dist 9.12858 6.30447 9.81831 8.96224 7.62611 4.4022 12.4934 7.8435 16.1023 14.9656 numMergedOcc 0
2 mol 93 unq 1 iso 0 dist 9.81831 6.30447 9.12858 4.4022 7.62611 8.96224 13.1721 5.99269 11.0537 11.5397 numMergedOcc 0
3 mol 93 unq 1 iso 1 dist 9.12858 6.30447 9.81831 8.96224 7.62611 4.4022 11.0537 5.99269 13.1721 11.5397 numMergedOcc 0
4 mol 93 unq 2 iso 0 dist 9.81831 6.30447 9.12858 4.4022 7.62611 8.96224 9.34182 5.71763 12.0103 5.43515 numMergedOcc 0
5 mol 93 unq 2 iso 1 dist 9.12858 6.30447 9.81831 8.96224 7.62611 4.4022 12.0103 5.71763 9.34182 5.43515 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 9.81831 9.91939 9.4523 4.4022 7.62611 10.3849 16.1023 7.8435 10.8106 14.9656 numMergedOcc 0
7 mol 93 unq 3 iso 1 dist 9.4523 9.91939 9.81831 10.3849 7.62611 4.4022 10.8106 7.8435 16.1023 14.9656 numMergedOcc 0
8 mol 93 unq 4 iso 0 dist 9.81831 9.91939 9.4523 4.4022 7.62611 10.3849 13.1721 5.99269 7.14217 11.5397 numMergedOcc 0
9 mol 93 unq 4 iso 1 dist 9.4523 9.91939 9.81831 10.3849 7.62611 4.4022 7.14217 5.99269 13.1721 11.5397 numMergedOcc 0
10 mol 93 unq 5 iso 0 dist 9.81831 9.91939 9.4523 4.4022 7.62611 10.3849 9.34182 5.71763 12.9351 5.43515 numMergedOcc 0
11 mol 93 unq 5 iso 1 dist 9.4523 9.91939 9.81831 10.3849 7.62611 4.4022 12.9351 5.71763 9.34182 5.43515 numMergedOcc 0
12 mol 93 unq 3 iso 0 dist 9.12858 7.66728 9.4523 8.96224 7.62611 10.3849 12.4934 7.8435 10.8106 14.9656 numMergedOcc 0
13 mol 93 unq 3 iso 1 dist 9.4523 7.66728 9.12858 10.3849 7.62611 8.96224 10.8106 7.8435 12.4934 14.9656 numMergedOcc 0
14 mol 93 unq 4 iso 0 dist 9.12858 7.66728 9.4523 8.96224 7.62611 10.3849 11.0537 5.99269 7.14217 11.5397 numMergedOcc 0
15 mol 93 unq 4 iso 1 dist 9.4523 7.66728 9.12858 10.3849 7.62611 8.96224 7.14217 5.99269 11.0537 11.5397 numMergedOcc 0
16 mol 93 unq 5 iso 0 dist 9.12858 7.66728 9.4523 8.96224 7.62611 10.3849 12.0103 5.71763 12.9351 5.43515 numMergedOcc 0
17 mol 93 unq 5 iso 1 dist 9.4523 7.66728 9.12858 10.3849 7.62611 8.96224 12.9351 5.71763 12.0103 5.43515 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 9.15431 7.58238 6.92648 6.51918 5.44303 7.92788 4.57579 6.78801 8.57203 6.11089 numMergedOcc 0
19 mol 131 unq 0 iso 1 dist 6.92648 7.58238 9.15431 7.92788 5.44303 6.51918 8.57203 6.78801 4.57579 6.11089 numMergedOcc 0
20 mol 131 unq 1 iso 0 dist 9.15431 7.58238 6.92648 9.60968 8.50562 8.23791 4.57579 6.78801 8.57203 10.9311 numMergedOcc 0
21 mol 131 unq 1 iso 1 dist 6.92648 7.58238 9.15431 8.23791 8.50562 9.60968 8.57203 6.78801 4.57579 10.9311 numMergedOcc 0
22 mol 131 unq 2 iso 0 dist 9.15431 13.2572 9.29384 6.51918 5.44303 13.1439 4.57579 6.78801 12.6005 6.11089 numMergedOcc 0
23 mol 131 unq 2 iso 1 dist 9.29384 13.2572 9.15431 13.1439 5.44303 6.51918 12.6005 6.78801 4.57579 6.11089 numMergedOcc 0
24 mol 131 unq 3 iso 0 dist 9.15431 13.2572 9.29384 9.60968 8.50562 13.7237 4.57579 6.78801 12.6005 10.9311 numMergedOcc 0
25 mol 131 unq 3 iso 1 dist 9.29384 13.2572 9.15431 13.7237 8.50562 9.60968 12.6005 6.78801 4.57579 10.9311 numMergedOcc 0
26 mol 131 unq 2 iso 0 dist 6.92648 6.63273 9.29384 7.92788 5.44303 13.1439 8.57203 6.78801 12.6005 6.11089 numMergedOcc 0
27 mol 131 unq 2 iso 1 dist 9.29384 6.63273 6.92648 13.1439 5.44303 7.92788 12.6005 6.78801 8.57203 6.11089 numMergedOcc 0
28 mol 131 unq 3 iso 0 dist 6.92648 6.63273 9.29384 8.23791 8.50562 13.7237 8.57203 6.78801 12.6005 10.9311 numMergedOcc 0
29 mol 131 unq 3 iso 1 dist 9.29384 6.63273 6.92648 13.7237 8.50562 8.23791 12.6005 6.78801 8.57203 10.9311 numMergedOcc 0
30 mol 134 unq 0 iso 0 dist 7.36779 5.62899 8.20836 7.1797 9.30061 4.57832 14.2036 8.48313 16.4114 16.1483 numMergedOcc 0
31 mol 134 unq 0 iso 1 dist 8.20836 5.62899 7.36779 4.57832 9.30061 7.1797 16.4114 8.48313 14.2036 16.1483 numMergedOcc 0
32 mol 134 unq 1 iso 0 dist 7.36779 5.62899 8.20836 7.1797 9.30061 4.57832 10.092 6.99345 12.8086 11.5269 numMergedOcc 0
33 mol 134 unq 1 iso 1 dist 8.20836 5.62899 7.36779 4.57832 9.30061 7.1797 12.8086 6.99345 10.092 11.5269 numMergedOcc 0
34 mol 134 unq 2 iso 0 dist 7.36779 5.62899 8.20836 7.1797 9.30061 4.57832 4.46337 5.11043 7.41373 6.93712 numMergedOcc 0
35 mol 134 unq 2 iso 1 dist 8.20836 5.62899 7.36779 4.57832 9.30061 7.1797 7.41373 5.11043 4.46337 6.93712 numMergedOcc 0
36 mol 141 unq 0 iso 0 dist 6.69515 6.21253 7.86572 10.1386 4.46777 10.1432 13.2918 6.77921 13.4066 3.98068 numMergedOcc 0
37 mol 141 unq 0 iso 1 dist 7.86572 6.21253 6.69515 10.1432 4.46777 10.1386 13.4066 6.77921 13.2918 3.98068 numMergedOcc 0
38 mol 141 unq 1 iso 0 dist 6.69515 6.21253 7.86572 7.42649 6.94988 9.43674 13.2918 6.77921 13.4066 10.1551 numMergedOcc 0
39 mol 141 unq 1 iso 1 dist 7.86572 6.21253 6.69515 9.43674 6.94988 7.42649 13.4066 6.77921 13.2918 10.1551 numMergedOcc 0
40 mol 147 unq 0 iso 0 dist 5.49226 7.15222 6.28351 11.1681 7.25644 5.50251 12.068 9.43989 5.59468 3.88427 numMergedOcc 0
41 mol 147 unq 0 iso 1 dist 6.28351 7.15222 5.49226 5.50251 7.25644 11.1681 5.59468 9.43989 12.068 3.88427 numMergedOcc 0
42 mol 186 unq 0 iso 0 dist 9.56197 9.41955 7.24795 9.74148 7.46987 7.30024 6.89047 8.57801 3.90244 6.18065 numMergedOcc 0
43 mol 186 unq 0 iso 1 dist 7.24795 9.41955 9.56197 7.30024 7.46987 9.74148 3.90244 8.57801 6.89047 6.18065 numMergedOcc 0
44 mol 186 unq 1 iso 0 dist 9.56197 8.04815 8.64409 9.74148 7.46987 11.6919 6.89047 8.57801 12.6058 6.18065 numMergedOcc 0
45 mol 186 unq 1 iso 1 dist 8.64409 8.04815 9.56197 11.6919 7.46987 9.74148 12.6058 8.57801 6.89047 6.18065 numMergedOcc 0
46 mol 186 unq 2 iso 0 dist 9.56197 5.92513 7.60202 9.74148 7.46987 5.3967 6.89047 8.57801 7.21555 6.18065 numMergedOcc 0
47 mol 186 unq 2 iso 1 dist 7.60202 5.92513 9.56197 5.3967 7.46987 9.74148 7.21555 8.57801 6.89047 6.18065 numMergedOcc 0
48 mol 186 unq 1 iso 0 dist 7.24795 13.684 8.64409 7.30024 7.46987 11.6919 3.90244 8.57801 12.6058 6.18065 numMergedOcc 0
49 mol 186 unq 1 iso 1 dist 8.64409 13.684 7.24795 11.6919 7.46987 7.30024 12.6058 8.57801 3.90244 6.18065 numMergedOcc 0
50 mol 186 unq 2 iso 0 dist 7.24795 9.45987 7.60202 7.30024 7.46987 5.3967 3.90244 8.57801 7.21555 6.18065 numMergedOcc 0
51 mol 186 unq 2 iso 1 dist 7.60202 9.45987 7.24795 5.3967 7.46987 7.30024 7.21555 8.57801 3.90244 6.18065 numMergedOcc 0
52 mol 186 unq 2 iso 0 dist 8.64409 7.18269 7.60202 11.6919 7.46987 5.3967 12.6058 8.57801 7.21555 6.18065 numMergedOcc 0
53 mol 186 unq 2 iso 1 dist 7.60202 7.18269 8.64409 5.3967 7.46987 11.6919 7.21555 8.57801 12.6058 6.18065 numMergedOcc 0
54 mol 194 unq 0 iso 0 dist 6.26839 8.0179 8.12346 11.6598 5.68348 12.0887 10.0756 5.53324 10.2793 4.002 numMergedOcc 0
55 mol 194 unq 0 iso 1 dist 8.12346 8.0179 6.26839 12.0887 5.68348 11.6598 10.2793 5.53324 10.0756 4.002 numMergedOcc 0
56 mol 194 unq 1 iso 0 dist 6.26839 8.0179 8.12346 11.6598 5.68348 12.0887 11.8031 6.72182 9.09233 7.41775 numMergedOcc 0
57 mol 194 unq 1 iso 1 dist 8.12346 8.0179 6.26839 12.0887 5.68348 11.6598 9.09233 6.72182 11.8031 7.41775 numMergedOcc 0
58 mol 194 unq 2 iso 0 dist 6.26839 14.6506 8.83356 11.6598 5.68348 7.11753 10.0756 5.53324 10.463 4.002 numMergedOcc 0
59 mol 194 unq 2 iso 1 dist 8.83356 14.6506 6.26839 7.11753 5.68348 11.6598 10.463 5.53324 10.0756 4.002 numMergedOcc 0
60 mol 194 unq 3 iso 0 dist 6.26839 14.6506 8.83356 11.6598 5.68348 7.11753 11.8031 6.72182 4.66791 7.41775 numMergedOcc 0
61 mol 194 unq 3 iso 1 dist 8.83356 14.6506 6.26839 7.11753 5.68348 11.6598 4.66791 6.72182 11.8031 7.41775 numMergedOcc 0
62 mol 194 unq 4 iso 0 dist 6.26839 8.48054 8.2654 11.6598 5.68348 12.8755 10.0756 5.53324 12.8494 4.002 numMergedOcc 0
63 mol 194 unq 4 iso 1 dist 8.2654 8.48054 6.26839 12.8755 5.68348 11.6598 12.8494 5.53324 10.0756 4.002 numMergedOcc 0
64 mol 194 unq 5 iso 0 dist 6.26839 8.48054 8.2654 11.6598 5.68348 12.8755 11.8031 6.72182 7.73551 7.41775 numMergedOcc 0
65 mol 194 unq 5 iso 1 dist 8.2654 8.48054 6.26839 12.8755 5.68348 11.6598 7.73551 6.72182 11.8031 7.41775 numMergedOcc 0
66 mol 194 unq 2 iso 0 dist 8.12346 13.5632 8.83356 12.0887 5.68348 7.11753 10.2793 5.53324 10.463 4.002 numMergedOcc 0
67 mol 194 unq 2 iso 1 dist 8.83356 13.5632 8.12346 7.11753 5.68348 12.0887 10.463 5.53324 10.2793 4.002 numMergedOcc 0
68 mol 194 unq 3 iso 0 dist 8.12346 13.5632 8.83356 12.0887 5.68348 7.11753 9.09233 6.72182 4.66791 7.41775 numMergedOcc 0
69 mol 194 unq 3 iso 1 dist 8.83356 13.5632 8.12346 7.11753 5.68348 12.0887 4.66791 6.72182 9.09233 7.41775 numMergedOcc 0
70 mol 194 unq 4 iso 0 dist 8.12346 6.26298 8.2654 12.0887 5.68348 12.8755 10.2793 5.53324 12.8494 4.002 numMergedOcc 0
71 mol 194 unq 4 iso 1 dist 8.2654 6.26298 8.12346 12.8755 5.68348 12.0887 12.8494 5.53324 10.2793 4.002 numMergedOcc 0
72 mol 194 unq 5 iso 0 dist 8.12346 6.26298 8.2654 12.0887 5.68348 12.8755 9.09233 6.72182 7.73551 7.41775 numMergedOcc 0
73 mol 194 unq 5 iso 1 dist 8.2654 6.26298 8.12346 12.8755 5.68348 12.0887 7.73551 6.72182 9.09233 7.41775 numMergedOcc 0
74 mol 194 unq 4 iso 0 dist 8.83356 11.6097 8.2654 7.11753 5.68348 12.8755 10.463 5.53324 12.8494 4.002 numMergedOcc 0
75 mol 194 unq 4 iso 1 dist 8.2654 11.6097 8.83356 12.8755 5.68348 7.11753 12.8494 5.53324 10.463 4.002 numMergedOcc 0
76 mol 194 unq 5 iso 0 dist 8.83356 11.6097 8.2654 7.11753 5.68348 12.8755 4.66791 6.72182 7.73551 7.41775 numMergedOcc 0
77 mol 194 unq 5 iso 1 dist 8.2654 11.6097 8.83356 12.8755 5.68348 7.11753 7.73551 6.72182 4.66791 7.41775 numMergedOcc 0
78 mol 218 unq 0 iso 0 dist 8.86175 4.72474 6.29511 4.92618 9.32945 7.84019 3.8877 8.04838 6.0516 6.95765 numMergedOcc 0
79 mol 218 unq 0 iso 1 dist 6.29511 4.72474 8.86175 7.84019 9.32945 4.92618 6.0516 8.04838 3.8877 6.95765 numMergedOcc 0
80 mol 222 unq 0 iso 0 dist 9.2581 9.57159 9.62632 5.89689 9.08955 10.6944 9.01393 7.97027 13.3586 4.67663 numMergedOcc 0
81 mol 222 unq 0 iso 1 dist 9.62632 9.57159 9.2581 10.6944 9.08955 5.89689 13.3586 7.97027 9.01393 4.67663 numMergedOcc 0
82 mol 222 unq 1 iso 0 dist 9.2581 9.57159 9.62632 5.89689 9.08955 10.6944 6.25425 6.81955 5.16212 9.32357 numMergedOcc 0
83 mol 222 unq 1 iso 1 dist 9.62632 9.57159 9.2581 10.6944 9.08955 5.89689 5.16212 6.81955 6.25425 9.32357 numMergedOcc 0
84 mol 222 unq 2 iso 0 dist 9.2581 9.57159 9.62632 5.89689 9.08955 10.6944 5.64455 4.9876 5.9478 6.37382 numMergedOcc 0
85 mol 222 unq 2 iso 1 dist 9.62632 9.57159 9.2581 10.6944 9.08955 5.89689 5.9478 4.9876 5.64455 6.37382 numMergedOcc 0
86 mol 222 unq 3 iso 0 dist 9.2581 9.57159 9.62632 8.92719 8.88664 15.4372 9.01393 7.97027 13.3586 4.00869 numMergedOcc 0
87 mol 222 unq 3 iso 1 dist 9.62632 9.57159 9.2581 15.4372 8.88664 8.92719 13.3586 7.97027 9.01393 4.00869 numMergedOcc 0
88 mol 222 unq 4 iso 0 dist 9.2581 9.57159 9.62632 8.92719 8.88664 15.4372 6.25425 6.81955 5.16212 12.2233 numMergedOcc 0
89 mol 222 unq 4 iso 1 dist 9.62632 9.57159 9.2581 15.4372 8.88664 8.92719 5.16212 6.81955 6.25425 12.2233 numMergedOcc 0
90 mol 222 unq 5 iso 0 dist 9.2581 9.57159 9.62632 8.92719 8.88664 15.4372 5.64455 4.9876 5.9478 9.60662 numMergedOcc 0
91 mol 222 unq 5 iso 1 dist 9.62632 9.57159 9.2581 15.4372 8.88664 8.92719 5.9478 4.9876 5.64455 9.60662 numMergedOcc 0
92 mol 222 unq 6 iso 0 dist 9.2581 9.57159 9.62632 5.82526 7.16819 12.9388 9.01393 7.97027 13.3586 6.23984 numMergedOcc 0
93 mol 222 unq 6 iso 1 dist 9.62632 9.57159 9.2581 12.9388 7.16819 5.82526 13.3586 7.97027 9.01393 6.23984 numMergedOcc 0
94 mol 222 unq 7 iso 0 dist 9.2581 9.57159 9.62632 5.82526 7.16819 12.9388 6.25425 6.81955 5.16212 8.87178 numMergedOcc 0
95 mol 222 unq 7 iso 1 dist 9.62632 9.57159 9.2581 12.9388 7.16819 5.82526 5.16212 6.81955 6.25425 8.87178 numMergedOcc 0
96 mol 222 unq 8 iso 0 dist 9.2581 9.57159 9.62632 5.82526 7.16819 12.9388 5.64455 4.9876 5.9478 7.13962 numMergedOcc 0
97 mol 222 unq 8 iso 1 dist 9.62632 9.57159 9.2581 12.9388 7.16819 5.82526 5.9478 4.9876 5.64455 7.13962 numMergedOcc 0
98 mol 222 unq 9 iso 0 dist 9.2581 10.5806 7.862 5.89689 9.08955 7.75466 9.01393 7.97027 8.84507 4.67663 numMergedOcc 0
99 mol 222 unq 9 iso 1 dist 7.862 10.5806 9.2581 7.75466 9.08955 5.89689 8.84507 7.97027 9.01393 4.67663 numMergedOcc 0
100 mol 222 unq 10 iso 0 dist 9.2581 10.5806 7.862 5.89689 9.08955 7.75466 6.25425 6.81955 8.67203 9.32357 numMergedOcc 0
101 mol 222 unq 10 iso 1 dist 7.862 10.5806 9.2581 7.75466 9.08955 5.89689 8.67203 6.81955 6.25425 9.32357 numMergedOcc 0
102 mol 222 unq 11 iso 0 dist 9.2581 10.5806 7.862 5.89689 9.08955 7.75466 5.64455 4.9876 6.02502 6.37382 numMergedOcc 0
103 mol 222 unq 11 iso 1 dist 7.862 10.5806 9.2581 7.75466 9.08955 5.89689 6.02502 4.9876 5.64455 6.37382 numMergedOcc 0
104 mol 222 unq 12 iso 0 dist 9.2581 10.5806 7.862 8.92719 8.88664 12.1951 9.01393 7.97027 8.84507 4.00869 numMergedOcc 0
105 mol 222 unq 12 iso 1 dist 7.862 10.5806 9.2581 12.1951 8.88664 8.92719 8.84507 7.97027 9.01393 4.00869 numMergedOcc 0
106 mol 222 unq 13 iso 0 dist 9.2581 10.5806 7.862 8.92719 8.88664 12.1951 6.25425 6.81955 8.67203 12.2233 numMergedOcc 0
107 mol 222 unq 13 iso 1 dist 7.862 10.5806 9.2581 12.1951 8.88664 8.92719 8.67203 6.81955 6.25425 12.2233 numMergedOcc 0
108 mol 222 unq 14 iso 0 dist 9.2581 10.5806 7.862 8.92719 8.88664 12.1951 5.64455 4.9876 6.02502 9.60662 numMergedOcc 0
109 mol 222 unq 14 iso 1 dist 7.862 10.5806 9.2581 12.1951 8.88664 8.92719 6.02502 4.9876 5.64455 9.60662 numMergedOcc 0
110 mol 222 unq 15 iso 0 dist 9.2581 10.5806 7.862 5.82526 7.16819 11.6161 9.01393 7.97027 8.84507 6.23984 numMergedOcc 0
111 mol 222 unq 15 iso 1 dist 7.862 10.5806 9.2581 11.6161 7.16819 5.82526 8.84507 7.97027 9.01393 6.23984 numMergedOcc 0
112 mol 222 unq 16 iso 0 dist 9.2581 10.5806 7.862 5.82526 7.16819 11.6161 6.25425 6.81955 8.67203 8.87178 numMergedOcc 0
113 mol 222 unq 16 iso 1 dist 7.862 10.5806 9.2581 11.6161 7.16819 5.82526 8.67203 6.81955 6.25425 8.87178 numMergedOcc 0
114 mol 222 unq 17 iso 0 dist 9.2581 10.5806 7.862 5.82526 7.16819 11.6161 5.64455 4.9876 6.02502 7.13962 numMergedOcc 0
115 mol 222 unq 17 iso 1 dist 7.862 10.5806 9.2581 11.6161 7.16819 5.82526 6.02502 4.9876 5.64455 7.13962 numMergedOcc 0
116 mol 222 unq 9 iso 0 dist 9.62632 6.9154 7.862 10.6944 9.08955 7.75466 13.3586 7.97027 8.84507 4.67663 numMergedOcc 0
117 mol 222 unq 9 iso 1 dist 7.862 6.9154 9.62632 7.75466 9.08955 10.6944 8.84507 7.97027 13.3586 4.67663 numMergedOcc 0
118 mol 222 unq 10 iso 0 dist 9.62632 6.9154 7.862 10.6944 9.08955 7.75466 5.16212 6.81955 8.67203 9.32357 numMergedOcc 0
119 mol 222 unq 10 iso 1 dist 7.862 6.9154 9.62632 7.75466 9.08955 10.6944 8.67203 6.81955 5.16212 9.32357 numMergedOcc 0
120 mol 222 unq 11 iso 0 dist 9.62632 6.9154 7.862 10.6944 9.08955 7.75466 5.9478 4.9876 6.02502 6.37382 numMergedOcc 0
121 mol 222 unq 11 iso 1 dist 7.862 6.9154 9.62632 7.75466 9.08955 10.6944 6.02502 4.9876 5.9478 6.37382 numMergedOcc 0
122 mol 222 unq 12 iso 0 dist 9.62632 6.9154 7.862 15.4372 8.88664 12.1951 13.3586 7.97027 8.84507 4.00869 numMergedOcc 0
123 mol 222 unq 12 iso 1 dist 7.862 6.9154 9.62632 12.1951 8.88664 15.4372 8.84507 7.97027 13.3586 4.00869 numMergedOcc 0
124 mol 222 unq 13 iso 0 dist 9.62632 6.9154 7.862 15.4372 8.88664 12.1951 5.16212 6.81955 8.67203 12.2233 numMergedOcc 0
125 mol 222 unq 13 iso 1 dist 7.862 6.9154 9.62632 12.1951 8.88664 15.4372 8.67203 6.81955 5.16212 12.2233 numMergedOcc 0
126 mol 222 unq 14 iso 0 dist 9.62632 6.9154 7.862 15.4372 8.88664 12.1951 5.9478 4.9876 6.02502 9.60662 numMergedOcc 0
127 mol 222 unq 14 iso 1 dist 7.862 6.9154 9.62632 12.1951 8.88664 15.4372 6.02502 4.9876 5.9478 9.60662 numMergedOcc 0
128 mol 222 unq 15 iso 0 dist 9.62632 6.9154 7.862 12.9388 7.16819 11.6161 13.3586 7.97027 8.84507 6.23984 numMergedOcc 0
129 mol 222 unq 15 iso 1 dist 7.862 6.9154 9.62632 11.6161 7.16819 12.9388 8.84507 7.97027 13.3586 6.23984 numMergedOcc 0
130 mol 222 unq 16 iso 0 dist 9.62632 6.9154 7.862 12.9388 7.16819 11.6161 5.16212 6.81955 8.67203 8.87178 numMergedOcc 0
131 mol 222 unq 16 iso 1 dist 7.862 6.9154 9.62632 11.6161 7.16819 12.9388 8.67203 6.81955 5.16212 8.87178 numMergedOcc 0
132 mol 222 unq 17 iso 0 dist 9.62632 6.9154 7.862 12.9388 7.16819 11.6161 5.9478 4.9876 6.02502 7.13962 numMergedOcc 0
133 mol 222 unq 17 iso 1 dist 7.862 6.9154 9.62632 11.6161 7.16819 12.9388 6.02502 4.9876 5.9478 7.13962 numMergedOcc 0
134 mol 264 unq 0 iso 0 dist 6.04162 4.92077 6.14323 6.26382 7.21655 5.24812 11.4167 7.14086 13.2035 13.0036 numMergedOcc 0
135 mol 264 unq 0 iso 1 dist 6.14323 4.92077 6.04162 5.24812 7.21655 6.26382 13.2035 7.14086 11.4167 13.0036 numMergedOcc 0
136 mol 279 unq 0 iso 0 dist 8.29305 6.67478 6.43341 9.37316 9.30921 5.58929 6.5644 5.8304 9.40912 11.0079 numMergedOcc 0
137 mol 279 unq 0 iso 1 dist 6.43341 6.67478 8.29305 5.58929 9.30921 9.37316 9.40912 5.8304 6.5644 11.0079 numMergedOcc 0
138 mol 279 unq 1 iso 0 dist 8.29305 6.67478 6.43341 9.37316 9.30921 5.58929 8.70069 7.37478 4.14939 9.53157 numMergedOcc 0
139 mol 279 unq 1 iso 1 dist 6.43341 6.67478 8.29305 5.58929 9.30921 9.37316 4.14939 7.37478 8.70069 9.53157 numMergedOcc 0
