0 mol 15 unq 0 iso 0 dist 9.20338 11.7203 8.21493 11.6322 7.12903 9.03536 14.5813 5.90976 8.38064 9.97507 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 9.20338 11.6322 7.12903 11.7203 8.21493 9.03536 14.5813 5.90976 9.97507 8.38064 numMergedOcc 0
2 mol 15 unq 2 iso 0 dist 9.20338 11.6322 7.12903 11.7203 8.21493 9.03536 14.2985 5.51916 6.82505 10.4158 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 5.77753 5.38671 7.03948 5.45161 5.47769 6.92781 8.33883 6.2983 5.05803 6.31718 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 5.77753 5.38671 7.03948 6.43294 6.58035 10.7015 8.33883 6.2983 5.05803 10.9143 numMergedOcc 0
5 mol 16 unq 2 iso 0 dist 5.77753 5.45161 5.47769 5.38671 7.03948 6.92781 8.33883 6.2983 6.31718 5.05803 numMergedOcc 0
6 mol 16 unq 3 iso 0 dist 5.77753 5.45161 5.47769 5.38671 7.03948 6.92781 9.79958 5.94084 7.63133 12.5273 numMergedOcc 0
7 mol 16 unq 4 iso 0 dist 5.77753 5.45161 5.47769 6.43294 6.58035 5.32694 8.33883 6.2983 6.31718 10.9143 numMergedOcc 0
8 mol 16 unq 5 iso 0 dist 5.77753 5.45161 5.47769 6.43294 6.58035 5.32694 9.79958 5.94084 7.63133 5.46498 numMergedOcc 0
9 mol 16 unq 6 iso 0 dist 5.77753 6.43294 6.58035 5.38671 7.03948 10.7015 9.79958 5.94084 5.46498 12.5273 numMergedOcc 0
10 mol 16 unq 7 iso 0 dist 5.77753 6.43294 6.58035 5.45161 5.47769 5.32694 9.79958 5.94084 5.46498 7.63133 numMergedOcc 0
11 mol 19 unq 0 iso 0 dist 9.04865 12.4435 8.23643 9.84922 8.73972 5.03957 16.8224 11.0832 7.20519 12.1187 numMergedOcc 0
12 mol 19 unq 1 iso 0 dist 9.04865 12.4435 8.23643 9.84922 8.73972 5.03957 13.8602 6.55187 4.54938 7.82074 numMergedOcc 0
13 mol 19 unq 2 iso 0 dist 9.04865 12.4435 8.23643 9.84922 8.73972 5.03957 18.8997 12.3093 6.864 11.0366 numMergedOcc 0
14 mol 19 unq 3 iso 0 dist 9.04865 9.84922 8.73972 12.4435 8.23643 5.03957 13.8602 6.55187 7.82074 4.54938 numMergedOcc 0
15 mol 73 unq 0 iso 0 dist 6.4154 10.4716 8.70133 8.04817 5.64598 7.4697 11.7436 13.4082 9.38498 8.9232 numMergedOcc 0
16 mol 73 unq 1 iso 0 dist 6.4154 10.4716 8.70133 8.04817 5.64598 7.4697 6.89722 7.41074 9.96396 11.4799 numMergedOcc 0
17 mol 73 unq 2 iso 0 dist 6.4154 10.4716 8.70133 8.04817 5.64598 7.4697 14.4206 15.9882 9.75218 16.0453 numMergedOcc 0
18 mol 73 unq 3 iso 0 dist 6.4154 10.4716 8.70133 5.2774 4.65521 5.4148 11.7436 13.4082 9.38498 10.2049 numMergedOcc 0
19 mol 73 unq 4 iso 0 dist 6.4154 10.4716 8.70133 5.2774 4.65521 5.4148 6.89722 7.41074 9.96396 6.19304 numMergedOcc 0
20 mol 73 unq 5 iso 0 dist 6.4154 10.4716 8.70133 5.2774 4.65521 5.4148 14.4206 15.9882 9.75218 11.6369 numMergedOcc 0
21 mol 73 unq 6 iso 0 dist 6.4154 8.04817 5.64598 10.4716 8.70133 7.4697 11.905 9.77992 5.93252 13.1662 numMergedOcc 0
22 mol 73 unq 7 iso 0 dist 6.4154 8.04817 5.64598 5.2774 4.65521 5.7113 11.905 9.77992 5.93252 11.379 numMergedOcc 0
23 mol 73 unq 8 iso 0 dist 6.4154 5.2774 4.65521 10.4716 8.70133 5.4148 6.89722 7.41074 6.19304 9.96396 numMergedOcc 0
24 mol 73 unq 9 iso 0 dist 6.4154 5.2774 4.65521 8.04817 5.64598 5.7113 6.89722 7.41074 6.19304 11.4799 numMergedOcc 0
25 mol 100 unq 0 iso 0 dist 9.82043 5.2995 6.58204 7.58985 7.75343 5.88134 13.2687 10.9608 9.60661 6.65086 numMergedOcc 0
26 mol 100 unq 1 iso 0 dist 9.82043 5.2995 6.58204 7.58985 7.75343 5.88134 11.8029 5.01145 7.17106 10.5134 numMergedOcc 0
27 mol 100 unq 2 iso 0 dist 9.82043 5.2995 6.58204 7.58985 7.75343 5.88134 12.5343 5.69137 9.35224 6.56369 numMergedOcc 0
28 mol 100 unq 3 iso 0 dist 9.82043 7.58985 7.75343 5.2995 6.58204 5.88134 12.0248 15.209 7.47343 12.0662 numMergedOcc 0
29 mol 100 unq 4 iso 0 dist 9.82043 7.58985 7.75343 5.2995 6.58204 5.88134 13.2687 10.9608 6.65086 9.60661 numMergedOcc 0
30 mol 100 unq 5 iso 0 dist 9.82043 7.58985 7.75343 5.2995 6.58204 5.88134 12.5343 5.69137 6.56369 9.35224 numMergedOcc 0
31 mol 100 unq 6 iso 0 dist 9.82043 7.58985 7.75343 5.2995 6.58204 5.88134 15.2752 9.21622 9.30209 10.5853 numMergedOcc 0
32 mol 115 unq 0 iso 0 dist 5.60716 5.71451 6.50039 5.56084 6.87861 10.4294 8.81562 5.60178 4.99221 11.8322 numMergedOcc 0
33 mol 115 unq 1 iso 0 dist 5.52706 5.889 6.50039 6.98664 6.87861 10.4294 6.86946 5.60178 4.99221 11.8322 numMergedOcc 0
34 mol 127 unq 0 iso 0 dist 8.20636 16.0489 8.59981 6.93078 6.192 11.279 22.9955 14.9761 8.14887 19.0925 numMergedOcc 0
35 mol 127 unq 1 iso 0 dist 8.20636 16.0489 8.59981 6.93078 6.192 11.279 22.1143 14.085 9.30299 17.6472 numMergedOcc 0
36 mol 127 unq 2 iso 0 dist 8.20636 16.0489 8.59981 10.6558 7.69308 11.4958 22.9955 14.9761 8.14887 18.4772 numMergedOcc 0
37 mol 127 unq 3 iso 0 dist 8.20636 16.0489 8.59981 10.6558 7.69308 11.4958 22.1143 14.085 9.30299 15.0647 numMergedOcc 0
38 mol 127 unq 4 iso 0 dist 8.20636 16.0489 8.59981 12.8217 7.66331 5.55757 22.9955 14.9761 8.14887 12.8743 numMergedOcc 0
39 mol 127 unq 5 iso 0 dist 8.20636 16.0489 8.59981 12.8217 7.66331 5.55757 22.1143 14.085 9.30299 14.7391 numMergedOcc 0
40 mol 127 unq 6 iso 0 dist 8.03243 9.75166 8.59981 12.3873 6.192 11.279 12.4824 14.9761 8.14887 19.0925 numMergedOcc 0
41 mol 127 unq 7 iso 0 dist 8.03243 9.75166 8.59981 12.3873 6.192 11.279 8.40046 14.085 9.30299 17.6472 numMergedOcc 0
42 mol 127 unq 8 iso 0 dist 8.03243 9.75166 8.59981 9.8591 7.69308 11.4958 12.4824 14.9761 8.14887 18.4772 numMergedOcc 0
43 mol 127 unq 9 iso 0 dist 8.03243 9.75166 8.59981 9.8591 7.69308 11.4958 8.40046 14.085 9.30299 15.0647 numMergedOcc 0
44 mol 127 unq 10 iso 0 dist 8.03243 9.75166 8.59981 12.9471 7.66331 5.55757 12.4824 14.9761 8.14887 12.8743 numMergedOcc 0
45 mol 127 unq 11 iso 0 dist 8.03243 9.75166 8.59981 12.9471 7.66331 5.55757 8.40046 14.085 9.30299 14.7391 numMergedOcc 0
46 mol 130 unq 0 iso 0 dist 9.03277 10.8983 6.89257 5.72266 6.79146 6.83397 17.2149 8.84655 8.70949 13.7544 numMergedOcc 0
47 mol 130 unq 1 iso 0 dist 9.03277 10.8983 6.89257 5.96312 7.66168 7.50049 17.2149 8.84655 8.70949 13.572 numMergedOcc 0
48 mol 155 unq 0 iso 0 dist 5.64806 6.68061 7.16254 11.0287 9.14392 5.71071 9.70079 6.3845 6.23493 7.46303 numMergedOcc 0
49 mol 155 unq 1 iso 0 dist 5.64806 11.0287 9.14392 6.68061 7.16254 5.71071 9.70079 6.3845 7.46303 6.23493 numMergedOcc 0
50 mol 155 unq 2 iso 0 dist 5.64806 11.0287 9.14392 6.68061 7.16254 5.71071 15.6872 12.1814 6.43582 10.2463 numMergedOcc 0
51 mol 214 unq 0 iso 0 dist 6.35728 10.644 7.46831 4.82712 8.60247 10.3105 8.49704 6.67959 8.85478 11.9355 numMergedOcc 0
52 mol 224 unq 0 iso 0 dist 6.4508 5.41021 6.67585 4.91322 6.65984 4.70378 9.33771 5.29877 8.95269 6.57273 numMergedOcc 0
53 mol 224 unq 1 iso 0 dist 6.4508 4.91322 6.65984 5.41021 6.67585 4.70378 9.33771 5.29877 6.57273 8.95269 numMergedOcc 0
54 mol 224 unq 2 iso 0 dist 6.4508 4.91322 6.65984 5.41021 6.67585 4.70378 7.39839 6.12232 6.60589 9.99123 numMergedOcc 0
55 mol 227 unq 0 iso 0 dist 8.34104 14.9329 8.17891 13.2783 6.95902 5.22356 9.17826 6.43754 7.22101 8.65997 numMergedOcc 0
56 mol 227 unq 1 iso 0 dist 8.34104 14.9329 8.17891 13.2783 6.95902 5.22356 13.0242 9.13836 7.09863 10.8157 numMergedOcc 0
57 mol 227 unq 2 iso 0 dist 8.34104 13.2783 6.95902 14.9329 8.17891 5.22356 9.17826 6.43754 8.65997 7.22101 numMergedOcc 0
58 mol 235 unq 0 iso 0 dist 8.60471 5.47633 9.58736 10.2835 9.43058 9.85037 9.94654 9.66021 5.4638 11.9862 numMergedOcc 0
59 mol 235 unq 1 iso 0 dist 8.60471 5.47633 9.58736 12.4425 8.75735 13.6669 9.94654 9.66021 5.4638 15.2592 numMergedOcc 0
60 mol 235 unq 2 iso 0 dist 8.60471 5.47633 9.58736 15.2767 6.98084 16.4493 9.94654 9.66021 5.4638 15.3051 numMergedOcc 0
61 mol 235 unq 3 iso 0 dist 8.60471 5.47633 9.58736 11.9322 7.32211 15.4 9.94654 9.66021 5.4638 16.4776 numMergedOcc 0
62 mol 282 unq 0 iso 0 dist 5.2527 4.85461 6.85028 8.85797 7.32347 5.39891 9.63346 6.3384 8.04483 6.33524 numMergedOcc 0
63 mol 282 unq 1 iso 0 dist 5.2527 4.85461 6.85028 5.43514 8.3411 7.76539 9.63346 6.3384 8.04483 13.5481 numMergedOcc 0
64 mol 282 unq 2 iso 0 dist 5.2527 8.85797 7.32347 4.85461 6.85028 5.39891 9.63346 6.3384 6.33524 8.04483 numMergedOcc 0
65 mol 282 unq 3 iso 0 dist 5.2527 8.85797 7.32347 5.43514 8.3411 10.5372 9.63346 6.3384 6.33524 13.5481 numMergedOcc 0
