0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 6.58469 14.3576 8.60435 6.55304 6.7985 6.14469 12.4861 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 8.72114 13.8829 16.4405 22.1274 8.60435 6.34041 12.9581 6.14469 12.4861 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 9.62394 9.5997 11.0722 8.83269 8.076 16.147 14.519 7.35972 8.88528 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 9.62394 9.5997 11.0722 8.83269 8.076 19.4709 18.1148 9.93542 14.0736 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 8.57077 9.62394 9.5997 14.814 15.5119 6.32226 16.147 14.519 7.35972 4.58685 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 8.57077 9.62394 9.5997 14.814 15.5119 6.32226 19.4709 18.1148 9.93542 5.83039 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 8.4674 6.41575 4.64838 5.18512 10.1882 6.39966 9.74255 8.40416 9.95212 13.9675 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 4.54938 6.41575 4.97119 5.18512 6.92532 6.39966 9.74255 7.75618 9.95212 13.9675 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 7.82074 6.41575 6.01808 5.18512 6.36455 6.39966 9.74255 12.3215 9.95212 13.9675 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 4.51865 6.41423 4.64838 9.47529 10.1882 6.39966 7.08342 8.40416 9.95212 13.9675 numMergedOcc 0
10 mol 19 unq 4 iso 0 dist 6.864 6.41423 4.97119 9.47529 6.92532 6.39966 7.08342 7.75618 9.95212 13.9675 numMergedOcc 0
11 mol 24 unq 0 iso 0 dist 6.86014 7.33768 4.32034 6.00575 6.60423 9.69752 6.66749 9.41441 8.00171 11.9395 numMergedOcc 0
12 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 12.0003 13.0257 4.90592 6.66749 9.41441 6.72323 10.0715 numMergedOcc 0
13 mol 24 unq 2 iso 0 dist 6.86014 7.29868 8.52463 6.00575 6.60423 9.36461 6.66749 9.41441 6.72323 11.9395 numMergedOcc 0
14 mol 24 unq 3 iso 0 dist 6.86014 9.41441 6.66749 11.1124 11.1214 6.2004 4.32034 7.33768 8.00171 7.72688 numMergedOcc 0
15 mol 24 unq 4 iso 0 dist 6.86014 9.41441 6.66749 11.1124 11.1214 6.2004 12.2662 12.2059 5.95834 4.82556 numMergedOcc 0
16 mol 24 unq 5 iso 0 dist 6.86014 9.41441 6.66749 11.1124 11.1214 6.2004 8.67951 9.01567 4.2121 6.25108 numMergedOcc 0
17 mol 24 unq 6 iso 0 dist 6.86014 9.41441 6.66749 11.1124 11.1214 6.2004 8.52463 7.29868 6.72323 11.8207 numMergedOcc 0
18 mol 24 unq 7 iso 0 dist 8.86116 8.60554 8.52463 11.2106 13.0257 4.90592 14.012 9.41441 6.72323 10.0715 numMergedOcc 0
19 mol 24 unq 8 iso 0 dist 8.86116 8.60554 8.52463 5.97304 6.60423 9.36461 14.012 9.41441 6.72323 11.9395 numMergedOcc 0
20 mol 24 unq 9 iso 0 dist 8.86116 9.41441 14.012 11.1124 18.2639 6.2004 4.32034 12.9284 8.00171 7.72688 numMergedOcc 0
21 mol 24 unq 10 iso 0 dist 8.86116 9.41441 14.012 11.1124 18.2639 6.2004 12.2662 17.592 5.95834 4.82556 numMergedOcc 0
22 mol 24 unq 11 iso 0 dist 8.86116 9.41441 14.012 11.1124 18.2639 6.2004 8.67951 13.4393 4.2121 6.25108 numMergedOcc 0
23 mol 24 unq 12 iso 0 dist 8.86116 9.41441 14.012 11.1124 18.2639 6.2004 8.52463 8.60554 6.72323 11.8207 numMergedOcc 0
24 mol 24 unq 13 iso 0 dist 8.38394 8.60554 12.3994 11.2106 15.7639 4.90592 14.012 15.392 6.72323 10.0715 numMergedOcc 0
25 mol 24 unq 14 iso 0 dist 8.38394 8.60554 12.3994 5.97304 9.0934 9.36461 14.012 15.392 6.72323 11.9395 numMergedOcc 0
26 mol 24 unq 15 iso 0 dist 5.54419 8.4051 5.11617 4.33963 4.93188 4.90592 12.176 6.73939 6.72323 10.0715 numMergedOcc 0
27 mol 24 unq 16 iso 0 dist 5.54419 8.4051 5.11617 17.4067 14.156 9.36461 12.176 6.73939 6.72323 11.9395 numMergedOcc 0
28 mol 24 unq 17 iso 0 dist 5.54419 6.73939 12.176 10.2913 15.5937 6.2004 6.56748 11.3566 5.95834 4.82556 numMergedOcc 0
29 mol 24 unq 18 iso 0 dist 5.54419 6.73939 12.176 10.2913 15.5937 6.2004 4.50066 9.83002 4.2121 6.25108 numMergedOcc 0
30 mol 24 unq 19 iso 0 dist 5.54419 6.73939 12.176 10.2913 15.5937 6.2004 11.9112 16.8439 8.00171 7.72688 numMergedOcc 0
31 mol 24 unq 20 iso 0 dist 5.54419 6.73939 12.176 10.2913 15.5937 6.2004 5.11617 8.4051 6.72323 11.8207 numMergedOcc 0
32 mol 24 unq 21 iso 0 dist 7.36323 8.4051 13.2229 4.33963 9.24958 4.90592 12.176 18.673 6.72323 10.0715 numMergedOcc 0
33 mol 24 unq 22 iso 0 dist 7.36323 8.4051 13.2229 17.4067 20.2475 9.36461 12.176 18.673 6.72323 11.9395 numMergedOcc 0
34 mol 73 unq 0 iso 0 dist 9.96396 9.24757 5.11416 8.26458 7.04044 6.48232 6.29906 12.1382 8.87464 7.86177 numMergedOcc 0
35 mol 73 unq 1 iso 0 dist 6.19304 9.24757 6.56633 8.26458 8.73253 6.48232 6.29906 10.2755 8.87464 7.86177 numMergedOcc 0
36 mol 73 unq 2 iso 0 dist 8.70481 9.24757 15.3808 8.26458 10.3244 6.48232 6.29906 10.8139 8.87464 7.86177 numMergedOcc 0
37 mol 85 unq 0 iso 0 dist 7.97049 9.82915 9.29301 6.37974 7.1589 8.70863 10.4987 14.4725 9.66222 8.31077 numMergedOcc 0
38 mol 85 unq 1 iso 0 dist 7.47541 9.82915 13.5116 6.37974 11.2808 8.70863 10.4987 17.5738 9.66222 8.31077 numMergedOcc 0
39 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 7.32662 7.26086 8.43352 7.94178 11.3043 7.36769 8.02554 numMergedOcc 0
40 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 7.32662 7.26086 8.43352 4.4057 6.65501 6.88901 11.2092 numMergedOcc 0
41 mol 98 unq 2 iso 0 dist 6.10456 4.47349 7.06961 6.934 7.26086 8.43352 9.85543 11.3043 7.36769 8.02554 numMergedOcc 0
42 mol 98 unq 3 iso 0 dist 6.10456 4.47349 7.06961 6.934 7.26086 8.43352 9.67482 6.65501 6.88901 11.2092 numMergedOcc 0
43 mol 129 unq 0 iso 0 dist 9.61051 6.28565 6.30169 8.11992 15.6061 9.98397 10.7293 16.0242 9.73158 5.51078 numMergedOcc 0
44 mol 129 unq 1 iso 0 dist 9.61051 6.28565 6.30169 8.11992 15.6061 9.98397 7.29399 13.4182 7.59327 6.80501 numMergedOcc 0
45 mol 129 unq 2 iso 0 dist 9.61051 6.28565 6.30169 6.67948 15.3413 9.94578 10.7293 16.0242 9.73158 6.84211 numMergedOcc 0
46 mol 129 unq 3 iso 0 dist 9.61051 6.28565 6.30169 6.67948 15.3413 9.94578 7.29399 13.4182 7.59327 4.53459 numMergedOcc 0
47 mol 129 unq 4 iso 0 dist 5.83384 6.28565 4.55551 8.11992 10.0483 9.98397 10.7293 9.36851 9.73158 5.51078 numMergedOcc 0
48 mol 129 unq 5 iso 0 dist 5.83384 6.28565 4.55551 8.11992 10.0483 9.98397 7.29399 4.97175 7.59327 6.80501 numMergedOcc 0
49 mol 129 unq 6 iso 0 dist 5.83384 6.28565 4.55551 6.67948 8.03372 9.94578 10.7293 9.36851 9.73158 6.84211 numMergedOcc 0
50 mol 129 unq 7 iso 0 dist 5.83384 6.28565 4.55551 6.67948 8.03372 9.94578 7.29399 4.97175 7.59327 4.53459 numMergedOcc 0
51 mol 134 unq 0 iso 0 dist 9.89303 7.69991 4.60632 13.1292 13.6079 9.30061 7.41674 5.83771 6.40575 14.2253 numMergedOcc 0
52 mol 134 unq 1 iso 0 dist 6.54501 7.69991 5.71679 13.1292 13.846 9.30061 7.41674 7.80532 6.40575 14.2253 numMergedOcc 0
53 mol 134 unq 2 iso 0 dist 8.94367 6.23142 4.57832 9.4027 8.20836 9.30061 9.87376 10.5252 6.40575 14.2253 numMergedOcc 0
54 mol 134 unq 3 iso 0 dist 6.37586 6.23142 5.29786 9.4027 10.873 9.30061 9.87376 10.7586 6.40575 14.2253 numMergedOcc 0
55 mol 134 unq 4 iso 0 dist 6.49416 6.23142 5.71679 9.4027 13.846 9.30061 9.87376 7.80532 6.40575 14.2253 numMergedOcc 0
56 mol 134 unq 5 iso 0 dist 9.86662 9.94764 4.57832 5.12325 8.20836 9.30061 14.9876 10.5252 6.40575 14.2253 numMergedOcc 0
57 mol 134 unq 6 iso 0 dist 9.71307 9.94764 5.29786 5.12325 10.873 9.30061 14.9876 10.7586 6.40575 14.2253 numMergedOcc 0
58 mol 181 unq 0 iso 0 dist 5.98885 9.72611 5.6044 5.93488 6.51749 7.11785 12.7358 11.602 7.22883 8.30281 numMergedOcc 0
59 mol 181 unq 1 iso 0 dist 9.09537 9.72611 12.9468 5.93488 7.20392 7.11785 12.7358 14.8662 7.22883 8.30281 numMergedOcc 0
60 mol 232 unq 0 iso 0 dist 8.27212 9.05071 8.80479 14.8035 14.6969 8.28466 4.9377 9.40808 9.8664 12.721 numMergedOcc 0
61 mol 232 unq 1 iso 0 dist 8.27212 9.40808 4.9377 8.25884 7.83711 6.57921 12.5452 13.7227 9.78181 7.86594 numMergedOcc 0
62 mol 232 unq 2 iso 0 dist 8.27212 9.40808 4.9377 8.25884 7.83711 6.57921 8.80479 9.05071 9.8664 13.8622 numMergedOcc 0
63 mol 274 unq 0 iso 0 dist 7.56915 8.52587 5.29529 5.90436 9.56685 8.2997 6.20558 9.85289 6.88827 5.36428 numMergedOcc 0
64 mol 274 unq 1 iso 0 dist 7.56915 8.52587 5.29529 5.90436 9.56685 8.2997 16.3619 14.1515 9.16942 14.986 numMergedOcc 0
