0 mol 7 unq 0 iso 0 dist 6.02702 6.58469 8.60435 6.55304 6.14469 12.4861 9.60499 8.43473 14.3576 6.7985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.02702 6.58469 8.60435 6.55304 6.14469 12.4861 10.6581 5.03847 11.8684 9.68596 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.72114 16.4405 8.60435 6.34041 6.14469 12.4861 11.0773 8.43473 14.3576 6.7985 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.72114 16.4405 8.60435 6.34041 6.14469 12.4861 10.5461 5.03847 11.8684 9.68596 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 9.62394 11.0722 8.076 16.147 7.35972 8.88528 15.1483 8.50424 7.05346 7.32257 numMergedOcc 0
5 mol 9 unq 1 iso 0 dist 9.62394 11.0722 8.076 16.147 7.35972 8.88528 14.896 6.02809 10.5699 6.55811 numMergedOcc 0
6 mol 9 unq 2 iso 0 dist 9.62394 11.0722 8.076 16.147 7.35972 8.88528 13.3648 4.98827 12.6235 8.64915 numMergedOcc 0
7 mol 9 unq 3 iso 0 dist 9.62394 11.0722 8.076 19.4709 9.93542 14.0736 14.896 6.02809 10.5699 7.36018 numMergedOcc 0
8 mol 9 unq 4 iso 0 dist 9.62394 11.0722 8.076 19.4709 9.93542 14.0736 13.3648 4.98827 12.6235 8.17347 numMergedOcc 0
9 mol 9 unq 5 iso 0 dist 9.62394 14.814 6.32226 16.147 7.35972 4.58685 15.1483 8.50424 10.8213 7.32257 numMergedOcc 0
10 mol 9 unq 6 iso 0 dist 9.62394 14.814 6.32226 16.147 7.35972 4.58685 14.896 6.02809 7.9944 6.55811 numMergedOcc 0
11 mol 9 unq 7 iso 0 dist 9.62394 14.814 6.32226 16.147 7.35972 4.58685 13.3648 4.98827 7.032 8.64915 numMergedOcc 0
12 mol 9 unq 8 iso 0 dist 9.62394 14.814 6.32226 19.4709 9.93542 5.83039 14.896 6.02809 7.9944 7.36018 numMergedOcc 0
13 mol 9 unq 9 iso 0 dist 9.62394 14.814 6.32226 19.4709 9.93542 5.83039 13.3648 4.98827 7.032 8.17347 numMergedOcc 0
14 mol 9 unq 10 iso 0 dist 7.32257 9.87669 6.59455 8.50424 7.35972 13.7528 15.1483 16.147 21.9534 9.62394 numMergedOcc 0
15 mol 9 unq 11 iso 0 dist 6.55811 11.4245 6.59455 6.02809 7.35972 13.7528 14.896 16.147 21.9534 9.62394 numMergedOcc 0
16 mol 9 unq 12 iso 0 dist 8.64915 14.7278 6.59455 4.98827 7.35972 13.7528 13.3648 16.147 21.9534 9.62394 numMergedOcc 0
17 mol 19 unq 0 iso 0 dist 6.41575 5.18512 6.39966 9.74255 9.95212 13.9675 8.4674 4.64838 10.1882 8.40416 numMergedOcc 0
18 mol 19 unq 1 iso 0 dist 6.41575 5.18512 6.39966 9.74255 9.95212 13.9675 4.54938 4.97119 6.92532 7.75618 numMergedOcc 0
19 mol 19 unq 2 iso 0 dist 6.41423 9.47529 6.39966 7.08342 9.95212 13.9675 4.51865 4.64838 10.1882 8.40416 numMergedOcc 0
20 mol 19 unq 3 iso 0 dist 6.41423 9.47529 6.39966 7.08342 9.95212 13.9675 6.864 4.97119 6.92532 7.75618 numMergedOcc 0
21 mol 24 unq 0 iso 0 dist 7.33768 6.00575 9.69752 6.66749 8.00171 11.9395 6.86014 4.32034 6.60423 9.41441 numMergedOcc 0
22 mol 24 unq 1 iso 0 dist 7.33768 6.00575 9.69752 6.66749 8.00171 11.9395 11.0194 11.9112 14.156 6.73939 numMergedOcc 0
23 mol 24 unq 2 iso 0 dist 9.41441 11.1124 6.2004 4.32034 8.00171 7.72688 6.86014 6.66749 11.1214 7.33768 numMergedOcc 0
24 mol 24 unq 3 iso 0 dist 9.41441 11.1124 6.2004 8.67951 4.2121 6.25108 6.86014 6.66749 11.1214 9.01567 numMergedOcc 0
25 mol 24 unq 4 iso 0 dist 9.41441 11.1124 6.2004 8.52463 6.72323 11.8207 15.5324 12.176 15.5937 8.4051 numMergedOcc 0
26 mol 24 unq 5 iso 0 dist 9.41441 11.1124 6.2004 8.52463 6.72323 11.8207 6.86014 6.66749 11.1214 7.29868 numMergedOcc 0
27 mol 24 unq 6 iso 0 dist 9.41441 11.1124 6.2004 8.52463 6.72323 11.8207 8.86116 14.012 18.2639 8.60554 numMergedOcc 0
28 mol 24 unq 7 iso 0 dist 6.73939 10.2913 6.2004 4.50066 4.2121 6.25108 11.0194 6.66749 11.1214 9.01567 numMergedOcc 0
29 mol 24 unq 8 iso 0 dist 6.73939 10.2913 6.2004 11.9112 8.00171 7.72688 11.0194 6.66749 11.1214 7.33768 numMergedOcc 0
30 mol 24 unq 9 iso 0 dist 6.73939 10.2913 6.2004 5.11617 6.72323 11.8207 5.54419 12.176 15.5937 8.4051 numMergedOcc 0
31 mol 24 unq 10 iso 0 dist 6.73939 10.2913 6.2004 5.11617 6.72323 11.8207 11.0194 6.66749 11.1214 7.29868 numMergedOcc 0
32 mol 24 unq 11 iso 0 dist 6.73939 10.2913 6.2004 5.11617 6.72323 11.8207 13.2433 14.012 18.2639 8.60554 numMergedOcc 0
33 mol 24 unq 12 iso 0 dist 8.4051 4.33963 4.90592 12.176 6.72323 10.0715 15.5324 8.52463 13.0257 9.41441 numMergedOcc 0
34 mol 24 unq 13 iso 0 dist 8.4051 4.33963 4.90592 12.176 6.72323 10.0715 5.54419 5.11617 4.93188 6.73939 numMergedOcc 0
35 mol 24 unq 14 iso 0 dist 8.4051 17.4067 9.36461 12.176 6.72323 11.9395 15.5324 8.52463 6.60423 9.41441 numMergedOcc 0
36 mol 24 unq 15 iso 0 dist 8.4051 17.4067 9.36461 12.176 6.72323 11.9395 5.54419 5.11617 14.156 6.73939 numMergedOcc 0
37 mol 24 unq 16 iso 0 dist 7.29868 12.0003 4.90592 6.66749 6.72323 10.0715 6.86014 8.52463 13.0257 9.41441 numMergedOcc 0
38 mol 24 unq 17 iso 0 dist 7.29868 12.0003 4.90592 6.66749 6.72323 10.0715 11.0194 5.11617 4.93188 6.73939 numMergedOcc 0
39 mol 24 unq 18 iso 0 dist 7.29868 6.00575 9.36461 6.66749 6.72323 11.9395 6.86014 8.52463 6.60423 9.41441 numMergedOcc 0
40 mol 24 unq 19 iso 0 dist 7.29868 6.00575 9.36461 6.66749 6.72323 11.9395 11.0194 5.11617 14.156 6.73939 numMergedOcc 0
41 mol 24 unq 20 iso 0 dist 8.60554 11.2106 4.90592 14.012 6.72323 10.0715 8.86116 8.52463 13.0257 9.41441 numMergedOcc 0
42 mol 24 unq 21 iso 0 dist 8.60554 11.2106 4.90592 14.012 6.72323 10.0715 13.2433 5.11617 4.93188 6.73939 numMergedOcc 0
43 mol 24 unq 22 iso 0 dist 8.60554 5.97304 9.36461 14.012 6.72323 11.9395 8.86116 8.52463 6.60423 9.41441 numMergedOcc 0
44 mol 24 unq 23 iso 0 dist 8.60554 5.97304 9.36461 14.012 6.72323 11.9395 13.2433 5.11617 14.156 6.73939 numMergedOcc 0
45 mol 98 unq 0 iso 0 dist 6.7117 7.32662 8.43352 4.4057 6.88901 11.2092 5.08437 7.06961 7.26086 6.65501 numMergedOcc 0
46 mol 98 unq 1 iso 0 dist 4.47349 6.934 8.43352 9.67482 6.88901 11.2092 6.10456 7.06961 7.26086 6.65501 numMergedOcc 0
47 mol 98 unq 2 iso 0 dist 5.65185 7.17433 8.43352 12.0974 6.88901 11.2092 10.1136 7.06961 7.26086 6.65501 numMergedOcc 0
48 mol 129 unq 0 iso 0 dist 6.28565 8.11992 9.98397 10.7293 9.73158 5.51078 5.83384 4.55551 10.0483 9.36851 numMergedOcc 0
49 mol 129 unq 1 iso 0 dist 6.28565 8.11992 9.98397 7.29399 7.59327 6.80501 5.83384 4.55551 10.0483 4.97175 numMergedOcc 0
50 mol 129 unq 2 iso 0 dist 6.28565 6.67948 9.94578 10.7293 9.73158 6.84211 5.83384 4.55551 8.03372 9.36851 numMergedOcc 0
51 mol 129 unq 3 iso 0 dist 6.28565 6.67948 9.94578 7.29399 7.59327 4.53459 5.83384 4.55551 8.03372 4.97175 numMergedOcc 0
52 mol 134 unq 0 iso 0 dist 7.69991 13.1292 9.30061 7.41674 6.40575 14.2253 9.89303 4.60632 13.6079 5.83771 numMergedOcc 0
53 mol 134 unq 1 iso 0 dist 7.69991 13.1292 9.30061 7.41674 6.40575 14.2253 6.54501 5.71679 13.846 7.80532 numMergedOcc 0
54 mol 134 unq 2 iso 0 dist 6.23142 9.4027 9.30061 9.87376 6.40575 14.2253 9.93925 4.60632 13.6079 5.83771 numMergedOcc 0
55 mol 134 unq 3 iso 0 dist 6.23142 9.4027 9.30061 9.87376 6.40575 14.2253 6.49416 5.71679 13.846 7.80532 numMergedOcc 0
56 mol 134 unq 4 iso 0 dist 9.94764 5.12325 9.30061 14.9876 6.40575 14.2253 14.423 4.60632 13.6079 5.83771 numMergedOcc 0
57 mol 134 unq 5 iso 0 dist 9.94764 5.12325 9.30061 14.9876 6.40575 14.2253 12.5075 5.71679 13.846 7.80532 numMergedOcc 0
58 mol 156 unq 0 iso 0 dist 9.00416 12.962 7.46845 10.8404 8.21184 12.4049 11.6719 5.81563 5.38091 7.30357 numMergedOcc 0
59 mol 156 unq 1 iso 0 dist 9.00416 12.962 7.46845 5.18356 5.9976 11.7015 11.6719 5.81563 5.38091 8.61587 numMergedOcc 0
60 mol 171 unq 0 iso 0 dist 9.61462 5.487 8.1536 11.5561 5.25109 9.18337 13.05 4.78075 12.6307 6.64834 numMergedOcc 0
61 mol 171 unq 1 iso 0 dist 9.61462 5.487 8.1536 11.5561 5.25109 9.18337 14.9792 7.9651 14.2846 5.93786 numMergedOcc 0
62 mol 171 unq 2 iso 0 dist 9.61462 5.487 8.1536 11.5561 5.25109 9.18337 16.2078 12.6853 15.3908 8.24693 numMergedOcc 0
63 mol 171 unq 3 iso 0 dist 9.61462 5.487 8.1536 11.5561 5.25109 9.18337 15.4802 5.90026 13.1421 7.36698 numMergedOcc 0
64 mol 171 unq 4 iso 0 dist 9.61462 5.487 8.1536 10.844 8.21618 8.83874 14.9792 7.9651 14.2846 8.1344 numMergedOcc 0
65 mol 171 unq 5 iso 0 dist 9.61462 5.487 8.1536 10.844 8.21618 8.83874 16.2078 12.6853 15.3908 6.71356 numMergedOcc 0
66 mol 171 unq 6 iso 0 dist 6.64834 6.83134 7.32555 4.78075 5.25109 9.54524 13.05 11.5561 18.0501 9.61462 numMergedOcc 0
67 mol 171 unq 7 iso 0 dist 5.93786 4.44751 7.32555 7.9651 5.25109 9.54524 14.9792 11.5561 18.0501 9.61462 numMergedOcc 0
68 mol 171 unq 8 iso 0 dist 8.24693 9.61561 7.32555 12.6853 5.25109 9.54524 16.2078 11.5561 18.0501 9.61462 numMergedOcc 0
69 mol 171 unq 9 iso 0 dist 7.36698 6.66219 7.32555 5.90026 5.25109 9.54524 15.4802 11.5561 18.0501 9.61462 numMergedOcc 0
70 mol 181 unq 0 iso 0 dist 9.72611 5.93488 7.11785 12.7358 7.22883 8.30281 15.333 6.29863 11.6563 5.9176 numMergedOcc 0
71 mol 232 unq 0 iso 0 dist 8.50102 5.8023 6.57921 12.3508 9.8664 13.8622 10.5803 4.9377 7.83711 9.05071 numMergedOcc 0
72 mol 232 unq 1 iso 0 dist 9.40808 8.25884 6.57921 8.80479 9.8664 13.8622 8.27212 4.9377 7.83711 9.05071 numMergedOcc 0
73 mol 232 unq 2 iso 0 dist 9.05071 14.8035 8.28466 4.9377 9.8664 12.721 10.5803 12.3508 14.8539 8.50102 numMergedOcc 0
74 mol 232 unq 3 iso 0 dist 9.05071 14.8035 8.28466 4.9377 9.8664 12.721 8.27212 8.80479 14.6969 9.40808 numMergedOcc 0
75 mol 237 unq 0 iso 0 dist 9.20822 5.65087 5.06628 10.6582 8.10254 5.90415 18.4477 11.1554 12.9119 9.16003 numMergedOcc 0
76 mol 237 unq 1 iso 0 dist 9.16003 7.80935 9.54499 11.1554 8.10254 9.25593 18.4477 10.6582 15.7018 9.20822 numMergedOcc 0
77 mol 237 unq 2 iso 0 dist 9.16003 5.51666 5.6703 11.1554 8.10254 6.26206 18.4477 10.6582 13.2536 9.20822 numMergedOcc 0
78 mol 274 unq 0 iso 0 dist 8.52587 5.90436 8.2997 6.20558 6.88827 5.36428 7.56915 5.29529 9.56685 9.85289 numMergedOcc 0
79 mol 274 unq 1 iso 0 dist 6.39866 10.4342 8.2997 6.16703 6.88827 5.36428 11.3168 5.29529 9.56685 9.85289 numMergedOcc 0
