0 mol 9 unq 0 iso 0 dist 8.77049 11.3797 6.33889 12.8762 11.4878 8.57077 6.67398 7.2199 5.60154 8.47421 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.95341 11.7623 6.33889 13.0231 11.4878 8.57077 9.03359 7.2199 5.60154 8.47421 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 6.61158 12.2588 7.12903 11.4555 5.51916 6.82505 11.2204 8.96967 5.55659 9.78051 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.62693 4.09495 9.16962 10.8071 11.887 8.34347 9.57165 15.0652 7.23546 6.73162 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.97117 5.3315 6.73162 6.88695 7.23546 8.34347 6.66387 15.0652 11.887 9.16962 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.68726 10.8906 8.24062 10.7681 5.3525 7.71095 5.85924 6.5096 5.33688 6.71911 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 5.82918 4.0486 9.2603 7.74197 6.95868 9.36773 10.0278 13.649 8.4283 8.66514 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 5.82918 4.0486 9.2603 7.74197 6.95868 9.36773 8.37153 12.48 5.37521 9.25235 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 5.58063 5.24961 7.64585 12.5192 10.2377 9.33865 10.3316 6.40036 10.7942 7.76729 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 5.58063 5.24961 7.64585 10.8398 10.8939 6.11741 15.6773 17.3282 10.8292 6.99777 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 5.58063 5.24961 7.64585 10.8398 10.8939 6.11741 9.62969 12.1188 6.12943 9.14376 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 9.16944 5.01118 9.17284 6.7973 4.9093 6.23493 5.10076 6.51096 6.3845 7.16254 numMergedOcc 0
12 mol 155 unq 1 iso 0 dist 9.16944 5.01118 9.17284 6.7973 4.9093 6.23493 9.64056 10.3514 5.86939 9.86313 numMergedOcc 0
13 mol 155 unq 2 iso 0 dist 9.16944 5.01118 9.17284 10.6879 6.3437 7.46303 5.10076 6.51096 6.3845 9.14392 numMergedOcc 0
14 mol 155 unq 3 iso 0 dist 9.16944 5.01118 9.17284 10.6879 6.3437 7.46303 9.64056 10.3514 5.86939 7.51198 numMergedOcc 0
15 mol 155 unq 4 iso 0 dist 7.50392 4.94973 9.38946 11.1867 12.8482 6.43582 16.4017 18.2998 12.1814 9.14392 numMergedOcc 0
16 mol 155 unq 5 iso 0 dist 7.50392 4.94973 9.38946 11.1867 12.8482 6.43582 9.36845 11.3251 6.34186 7.51198 numMergedOcc 0
17 mol 155 unq 6 iso 0 dist 8.02593 9.80448 7.36102 12.6683 8.27726 6.43582 12.4443 13.2154 12.1814 9.14392 numMergedOcc 0
18 mol 155 unq 7 iso 0 dist 8.02593 9.80448 7.36102 12.6683 8.27726 6.43582 5.92486 7.37901 6.34186 7.51198 numMergedOcc 0
19 mol 155 unq 8 iso 0 dist 8.77391 4.94973 7.36102 11.1867 8.27726 6.43582 16.4017 13.2154 12.1814 9.14392 numMergedOcc 0
20 mol 155 unq 9 iso 0 dist 8.77391 4.94973 7.36102 11.1867 8.27726 6.43582 9.36845 7.37901 6.34186 7.51198 numMergedOcc 0
21 mol 155 unq 10 iso 0 dist 7.62575 14.7279 9.86313 13.0657 5.86939 6.23493 12.8149 10.3514 4.9093 9.17284 numMergedOcc 0
22 mol 155 unq 11 iso 0 dist 7.62575 10.4606 7.51198 13.0657 5.86939 7.46303 12.8149 10.3514 6.3437 9.17284 numMergedOcc 0
23 mol 155 unq 12 iso 0 dist 7.62575 10.4606 7.51198 10.6076 6.34186 6.43582 8.63858 11.3251 12.8482 9.38946 numMergedOcc 0
24 mol 155 unq 13 iso 0 dist 7.62575 10.4606 7.51198 10.6076 6.34186 6.43582 4.40049 7.37901 8.27726 7.36102 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 8.45395 9.47799 6.94688 13.0329 5.86342 5.98885 13.9961 10.5561 5.4601 7.20046 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 8.45395 9.47799 6.94688 13.0329 5.86342 5.98885 17.8459 11.7007 10.0524 7.13543 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 8.45395 9.47799 6.94688 14.039 6.80228 9.15386 7.58472 8.20656 8.25067 9.6668 numMergedOcc 0
28 mol 181 unq 3 iso 0 dist 9.15368 9.09989 6.94688 12.9014 5.86342 5.98885 14.3484 10.5561 5.4601 7.20046 numMergedOcc 0
29 mol 181 unq 4 iso 0 dist 9.15368 9.09989 6.94688 12.9014 5.86342 5.98885 18.5885 11.7007 10.0524 7.13543 numMergedOcc 0
30 mol 181 unq 5 iso 0 dist 9.15368 9.09989 6.94688 12.9138 6.80228 9.15386 4.24915 8.20656 8.25067 9.6668 numMergedOcc 0
31 mol 181 unq 6 iso 0 dist 9.20477 4.98009 6.94688 10.3248 5.86342 5.98885 9.83377 10.5561 5.4601 7.20046 numMergedOcc 0
32 mol 181 unq 7 iso 0 dist 9.20477 4.98009 6.94688 10.3248 5.86342 5.98885 15.0198 11.7007 10.0524 7.13543 numMergedOcc 0
33 mol 181 unq 8 iso 0 dist 9.20477 4.98009 6.94688 11.7479 6.80228 9.15386 5.70246 8.20656 8.25067 9.6668 numMergedOcc 0
34 mol 181 unq 9 iso 0 dist 5.41368 9.47799 6.71012 13.0329 9.14057 5.98885 13.9961 9.94131 5.4601 7.20046 numMergedOcc 0
35 mol 181 unq 10 iso 0 dist 5.41368 9.47799 6.71012 13.0329 9.14057 5.98885 17.8459 12.8673 10.0524 7.13543 numMergedOcc 0
36 mol 181 unq 11 iso 0 dist 5.41368 9.47799 6.71012 14.039 11.6919 9.15386 7.58472 9.40622 8.25067 9.6668 numMergedOcc 0
37 mol 181 unq 12 iso 0 dist 7.96182 9.09989 6.71012 12.9014 9.14057 5.98885 14.3484 9.94131 5.4601 7.20046 numMergedOcc 0
38 mol 181 unq 13 iso 0 dist 7.96182 9.09989 6.71012 12.9014 9.14057 5.98885 18.5885 12.8673 10.0524 7.13543 numMergedOcc 0
39 mol 181 unq 14 iso 0 dist 7.96182 9.09989 6.71012 12.9138 11.6919 9.15386 4.24915 9.40622 8.25067 9.6668 numMergedOcc 0
40 mol 181 unq 15 iso 0 dist 7.90237 4.98009 6.71012 10.3248 9.14057 5.98885 9.83377 9.94131 5.4601 7.20046 numMergedOcc 0
41 mol 181 unq 16 iso 0 dist 7.90237 4.98009 6.71012 10.3248 9.14057 5.98885 15.0198 12.8673 10.0524 7.13543 numMergedOcc 0
42 mol 181 unq 17 iso 0 dist 7.90237 4.98009 6.71012 11.7479 11.6919 9.15386 5.70246 9.40622 8.25067 9.6668 numMergedOcc 0
43 mol 181 unq 18 iso 0 dist 9.70025 6.20895 7.37327 13.8362 11.1462 7.81386 12.6239 11.691 6.7991 4.93785 numMergedOcc 0
44 mol 181 unq 19 iso 0 dist 9.70025 6.20895 7.37327 10.0354 13.3389 7.63312 4.071 11.1129 4.80231 6.93764 numMergedOcc 0
45 mol 181 unq 20 iso 0 dist 6.17129 4.3158 4.93785 9.84952 6.7991 7.81386 11.14 12.2455 9.53462 7.98142 numMergedOcc 0
46 mol 181 unq 21 iso 0 dist 6.17129 4.3158 4.93785 9.84952 6.7991 7.81386 10.9006 11.691 11.1462 7.37327 numMergedOcc 0
47 mol 181 unq 22 iso 0 dist 5.83596 4.3226 4.93785 10.8641 6.7991 7.81386 13.5898 12.2455 9.53462 7.98142 numMergedOcc 0
48 mol 181 unq 23 iso 0 dist 5.83596 4.3226 4.93785 10.8641 6.7991 7.81386 15.3078 11.691 11.1462 7.37327 numMergedOcc 0
49 mol 235 unq 0 iso 0 dist 8.19915 6.84447 8.21247 9.11256 4.65302 5.4638 14.9183 11.9287 9.66021 9.58736 numMergedOcc 0
50 mol 238 unq 0 iso 0 dist 9.88122 11.9794 6.91569 17.949 10.9761 6.57393 17.9598 11.9092 6.20606 5.38637 numMergedOcc 0
51 mol 238 unq 1 iso 0 dist 9.94175 13.8985 5.38637 10.6346 6.20606 6.57393 11.9879 11.9092 10.9761 6.91569 numMergedOcc 0
52 mol 238 unq 2 iso 0 dist 8.81534 5.33567 5.38637 6.24928 6.20606 6.57393 6.66018 11.9092 10.9761 6.91569 numMergedOcc 0
53 mol 259 unq 0 iso 0 dist 8.46351 5.59901 7.76676 9.12507 5.32839 5.30224 4.09442 9.64797 5.31048 8.37865 numMergedOcc 0
54 mol 259 unq 1 iso 0 dist 9.53092 12.7699 8.37865 12.9189 5.31048 5.30224 17.5899 11.4462 4.99891 6.77938 numMergedOcc 0
55 mol 259 unq 2 iso 0 dist 9.53092 12.7699 8.37865 12.9189 5.31048 5.30224 15.3845 9.64797 5.32839 7.76676 numMergedOcc 0
56 mol 282 unq 0 iso 0 dist 9.20119 12.5533 6.85028 15.5242 6.3384 8.04483 21.4584 13.4504 10.1236 8.8673 numMergedOcc 0
57 mol 282 unq 1 iso 0 dist 9.20119 14.3567 7.32347 15.5242 6.3384 6.33524 21.4584 13.4504 7.36881 8.8673 numMergedOcc 0
58 mol 282 unq 2 iso 0 dist 8.96997 4.64783 6.85028 11.3408 6.3384 8.04483 14.0051 13.4504 10.1236 8.8673 numMergedOcc 0
59 mol 282 unq 3 iso 0 dist 8.96997 10.0286 7.32347 11.3408 6.3384 6.33524 14.0051 13.4504 7.36881 8.8673 numMergedOcc 0
